Structure Information
Structure

Compound Identification

SMILES

CC(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)COC1=C(C)C=C(C=C1C)[N+]([O-])=O)S(=O)(=O)C1=CC2=C(C=C1)N(CCN(C)C)C=N2

InChIKey

InChIKey=RECJHSYYQIKSDI-CQTOTRCISA-N

Formula

C35H46N6O7S

Mass

694.85

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylbutylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylbutylamines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrophenyl ether - Phenylbutylamine - Amphetamine or derivatives - Benzimidazole - Nitrobenzene - Nitrotoluene - Phenoxy compound - Nitroaromatic compound - M-xylene - Xylene - Phenol ether - Alkyl aryl ether - N-substituted imidazole - Organosulfonic acid amide - Azole - Imidazole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Tertiary aliphatic amine - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary alcohol - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Azacycle - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Ether - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic zwitterion - Alcohol - Organic salt - Organic oxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.

External Descriptors

Not available

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