Compound Identification
SMILES
COC1=CC=C(C=C1)[C@@H](C)N(CC1=CC=CC=C1)[C@@H](CC(=O)OC(C)(C)C)C1=CC=CC=C1Br
InChIKey
InChIKey=PCOLVSGPLPGUAI-ZBLYBZFDSA-N
Formula
C29H34BrNO3
Mass
524.499
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmethylamines
Alternative Parents
Phenoxy compounds Anisoles Methoxybenzenes Benzylamines Alkyl aryl ethers Aralkylamines Fatty acid esters Bromobenzenes Aryl bromides Trialkylamines Amino acids and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organobromides Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Anisole - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Fatty acid ester - Halobenzene - Aralkylamine - Fatty acyl - Aryl bromide - Aryl halide - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic oxide - Carbonyl group - Amine - Organic oxygen compound - Organohalogen compound - Organobromide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors
Not available