Compound Identification
SMILES
CCN(CC)CCCC(C)NC1=C2C=CC=C(Cl)C2=NC=C1C.OC(=O)C1=CC2=CC=CC=C2C(CC2=C(O)C(=CC3=CC=CC=C23)C(O)=O)=C1O
InChIKey
InChIKey=MOPSMPWJDKAIEN-UHFFFAOYSA-N
Formula
C42H44ClN3O6
Mass
722.28
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
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Subclass
Naphthalenecarboxylic acids and derivatives
- Level 5 Naphthalenecarboxylic acids
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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
Naphthalenecarboxylic acids
Alternative Parents
Naphthols and derivatives Chloroquinolines 4-aminoquinolines Salicylic acid and derivatives Secondary alkylarylamines Methylpyridines Aminopyridines and derivatives Dicarboxylic acids and derivatives Aryl chlorides Vinylogous acids Heteroaromatic compounds Trialkylamines Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
2-naphthalenecarboxylic acid - 4-aminoquinoline - Haloquinoline - Chloroquinoline - 2-naphthol - Aminoquinoline - Salicylic acid or derivatives - Quinoline - Hydroxybenzoic acid - Methylpyridine - Secondary aliphatic/aromatic amine - Aminopyridine - Pyridine - Dicarboxylic acid or derivatives - Aryl halide - Aryl chloride - Heteroaromatic compound - Vinylogous acid - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available