Compound Identification
SMILES
COC1=C(CN2CCNCC2)C=C(Br)C=C1
InChIKey
InChIKey=BVVSAQBPJQCNRL-UHFFFAOYSA-N
Formula
C12H17BrN2O
Mass
285.185
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 Methoxybenzenes Benzylamines Anisoles N-alkylpiperazines Bromobenzenes Aralkylamines Alkyl aryl ethers Aryl bromides Trialkylamines Dialkylamines Azacyclic compounds Organopnictogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Anisole - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - N-alkylpiperazine - Aralkylamine - Aryl bromide - Piperazine - Aryl halide - 1,4-diazinane - Tertiary amine - Tertiary aliphatic amine - Azacycle - Secondary amine - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Organooxygen compound - Amine - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteromonocyclic 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