Compound Identification
SMILES
CCC(CC)C1=CC=C(C=C1)N(CC1=CC=C(C=C1)C1=CSC(COC2=C(C=CC(=C2)C(O)=O)[N+]([O-])=O)=N1)C(C)C
InChIKey
InChIKey=SWXHDUYOMNERFX-UHFFFAOYSA-N
Formula
C32H35N3O5S
Mass
573.71
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Phenylmethylamines
- Level 5 Phenylbenzamines
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Subclass
Phenylmethylamines
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
Nitrobenzoic acids and derivatives Nitrophenyl ethers Phenylisopropylamines Benzoic acids Phenylpropanes Aniline and substituted anilines Benzoyl derivatives Benzylamines Dialkylarylamines Nitroaromatic compounds Phenoxy compounds Phenol ethers 2,4-disubstituted thiazoles Alkyl aryl ethers Heteroaromatic compounds Amino acids Carboxylic acids Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbenzamine - Nitrobenzoate - Nitrophenyl ether - Phenylisopropylamine - Phenylpropane - Nitrobenzene - Benzoic acid - Benzoic acid or derivatives - Nitroaromatic compound - Phenoxy compound - Phenol ether - Benzylamine - Benzoyl - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Aralkylamine - Thiazole - Heteroaromatic compound - Azole - Amino acid or derivatives - C-nitro compound - Organic nitro compound - Tertiary amine - Amino acid - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Ether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organic salt - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available