Compound Identification
SMILES
CCOC(=O)C1=CC(=C(NCC2=C(OCC3=CC=CC=C3)C=CC(Br)=C2)C=C1)[N+]([O-])=O
InChIKey
InChIKey=UQMBSJPCOQXEDQ-UHFFFAOYSA-N
Formula
C23H21BrN2O5
Mass
485.334
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 Aminobenzoic acids and derivatives Benzoic acid esters Nitrobenzenes Aniline and substituted anilines Benzoyl derivatives Benzylamines Nitroaromatic compounds Phenylalkylamines Phenoxy compounds Phenol ethers Alkyl aryl ethers Bromobenzenes Secondary alkylarylamines Aryl bromides Carboxylic acid esters Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organobromides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylbenzamine - Nitrobenzoate - Benzoate ester - Aminobenzoic acid or derivatives - Nitrobenzene - Benzoic acid or derivatives - Phenoxy compound - Benzylamine - Benzoyl - Nitroaromatic compound - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Alkyl aryl ether - Aralkylamine - Bromobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl bromide - Aryl halide - C-nitro compound - Carboxylic acid ester - Organic nitro compound - Amino acid or derivatives - Ether - Organic oxoazanium - Carboxylic acid derivative - Organic 1,3-dipolar compound - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic homomonocyclic 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