Compound Identification
SMILES
COC1=C(NC2=CC3=C(C=C2)C(C2=CC=CC=C2S(=O)(=O)NCCO)=C2C=C\C(C=C2O3)=N/C2=C(C)C=CC=C2C)C=C(C=C1)S(O)(=O)=O
InChIKey
InChIKey=LWJVBRUADWNBCJ-SBWWSWLISA-N
Formula
C36H33N3O8S2
Mass
699.79
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
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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
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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
Benzenesulfonamides Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Aminophenyl ethers Benzenesulfonyl compounds Methoxyanilines m-Xylenes Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Primary aromatic amines Organosulfonamides Secondary ketimines Heteroaromatic compounds Aminosulfonyl compounds Organosulfonic acids Secondary amines Alkanolamines Oxacyclic compounds Hydrocarbon derivatives Primary alcohols Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthene - Benzenesulfonate - Benzenesulfonamide - Aminophenyl ether - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Methoxyaniline - Phenol ether - Phenoxy compound - Anisole - Aniline or substituted anilines - M-xylene - Methoxybenzene - Xylene - Alkyl aryl ether - Primary aromatic amine - Benzenoid - Organosulfonic acid amide - Monocyclic benzene moiety - Aminosulfonyl compound - Secondary ketimine - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Heteroaromatic compound - Alkanolamine - Oxacycle - Ether - Secondary amine - Organonitrogen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Amine - Primary alcohol - 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