4-(2-chlorophenyl)-2,6-dimethyl-5-piperazin-1-ylcarbonyl-pyridine-3-carboxylic acid

Systemtic Name: 4-(2-chlorophenyl)-2,6-dimethyl-5-piperazin-1-ylcarbonyl-pyridine-3-carboxylic acid Openeye Name: 4-(2-chlorophenyl)-2,6-dimethyl-5-(piperazine-1-carbonyl)pyridine-3-carboxylic acid CAS Name: 4-(2-chlorophenyl)-2,6-dimethyl-5-[oxo(1-piperazinyl)methyl]-3-pyridinecarboxylic acid IUPAC Name: 4-(2-chlorophenyl)-2,6-dimethyl-5-(piperazine-1-carbonyl)pyridine-3-carboxylic acid Traditional Name: 4-(2-chlorophenyl)-2,6-dimethyl-5-(piperazine-1-carbonyl)nicotinic acid Formula: C19H20ClN3O3 MolecularWeight: 373.8334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C)C(=O)N2CCNCC2)C3=CC=CC=C3Cl)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C(=N1)C)C(=O)N2CCNCC2)C3=CC=CC=C3Cl)C(=O)O

InChI

InChI=1S/C19H20ClN3O3/c1-11-15(18(24)23-9-7-21-8-10-23)17(13-5-3-4-6-14(13)20)16(19(25)26)12(2)22-11/h3-6,21H,7-10H2,1-2H3,(H,25,26)