Compound Identification
SMILES
COC1=CC(C2C3=CCC4C(C3CC3C(=O)N(C(=O)C23C)C2=CC(=NN2C)C2=C(C)C3=C(S2)C=CC(Cl)=C3)C(=O)N(C4=O)C2=CC=C(NC3=CC=CC=C3)C=C2)=C(O)C=C1
InChIKey
InChIKey=ULRIURAPVZZZSZ-UHFFFAOYSA-N
Formula
C47H40ClN5O6S
Mass
838.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cyclohexylphenols
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cyclohexylphenols
Intermediate Tree Nodes
Not available
Direct Parent
Cyclohexylphenols
Alternative Parents
Phenylpyrrolidines Isoindolones Methoxyphenols 1-benzothiophenes 4-alkoxyphenols Aniline and substituted anilines Anisoles Phenoxy compounds Methoxybenzenes 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Pyrrolidine-2-ones Primary aromatic amines Aryl chlorides N-substituted carboxylic acid imides Heteroaromatic compounds Dicarboximides Thiophenes Pyrazoles Pyrroles Amino acids and derivatives Lactams Azacyclic compounds Secondary amines Hydrocarbon derivatives Carbonyl compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclohexylphenol - 1-phenylpyrrolidine - Methoxyphenol - Isoindolone - Isoindoline - Benzothiophene - 4-alkoxyphenol - 1-benzothiophene - Isoindole or derivatives - Methoxybenzene - Aniline or substituted anilines - Phenol ether - Anisole - Phenoxy compound - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Aryl halide - Carboxylic acid imide, n-substituted - 2-pyrrolidone - Pyrrolidone - Primary aromatic amine - Aryl chloride - Heteroaromatic compound - Azole - Pyrazole - Carboxylic acid imide - Pyrrole - Dicarboximide - Pyrrolidine - Thiophene - Lactam - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Ether - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclohexylphenols. These are compounds containing a cyclohexane lined to a phenol group.
External Descriptors
Not available