Compound Identification
SMILES
CCN(CC)CC.CCN(CC)CC.CCN(CC)CC.NC1=C(C2=C(C=C1)C(=C1C=CC(=N)C(=C1O2)S(O)(=O)=O)C1=C(C=C(C=C1)C(=O)N1CCC(CC1)C(=O)OC1=C(Cl)C=C(C=C1Cl)S(O)(=O)=O)C(O)=O)S(O)(=O)=O
InChIKey
InChIKey=RIGLFRMDOQSLJR-UHFFFAOYSA-N
Formula
C51H70Cl2N6O15S3
Mass
1174.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
-
Subclass
1-benzopyrans
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Level 5
Dibenzopyrans
- Level 6 Xanthenes
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Level 5
Dibenzopyrans
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Subclass
1-benzopyrans
-
Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Dibenzopyrans
Direct Parent
Xanthenes
Alternative Parents
1-benzoylpiperidines N-benzoylpiperidines Benzenesulfonic acids and derivatives Phenol esters 1-sulfo,2-unsubstituted aromatic compounds Benzamides Benzenesulfonyl compounds Benzoic acids Piperidinecarboxylic acids Phenoxy compounds Dichlorobenzenes Aryl chlorides Organosulfonic acids Tertiary carboxylic acid amides Sulfonyls Heteroaromatic compounds Carboxylic acid esters Amino acids Trialkylamines Carboxylic acids Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Organochlorides Primary amines Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Xanthene - 1-benzoylpiperidine - N-benzoylpiperidine - Phenol ester - Benzenesulfonate - Benzoic acid or derivatives - Piperidinecarboxylic acid - 1-sulfo,2-unsubstituted aromatic compound - Benzoic acid - N-acyl-piperidine - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Benzamide - Benzoyl - Phenoxy compound - 1,3-dichlorobenzene - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Tertiary aliphatic amine - Amino acid - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Tertiary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Primary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organochloride - Organic oxygen compound - Organohalogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring.
External Descriptors
Not available