Compound Identification
SMILES
COc1c(cc(Br)c2ccccc12)C(=O)NC[C@@H]1CCCN1C1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2
InChIKey
InChIKey=NCPWXKOHFJBWEP-LHHYNMKPSA-N
Formula
C27H33BrN2O2
Mass
497.477
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
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Subclass
Naphthalenecarboxylic acids and derivatives
- Level 5 Naphthalenecarboxamides
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Subclass
Naphthalenecarboxylic acids and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalenecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Naphthalenecarboxamides
Alternative Parents
3-halobenzoic acids and derivatives Anisoles Alkyl aryl ethers N-alkylpyrrolidines Aryl bromides Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalenecarboxamide - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Anisole - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - N-alkylpyrrolidine - Pyrrolidine - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Azacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenecarboxamides. These are compounds containing a naphthalene moiety, which bears a carboxylic acid amide group at one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene rings.
External Descriptors
Not available