4-(3-chlorophenyl)-2,6-dimethyl-5-(4-oxidanylpiperidin-1-yl)carbonyl-pyridine-3-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-(4-oxidanylpiperidin-1-yl)carbonyl-pyridine-3-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-5-(4-hydroxypiperidine-1-carbonyl)-2,6-dimethyl-pyridine-3-carboxylic acid CAS Name: 4-(3-chlorophenyl)-5-[(4-hydroxy-1-piperidinyl)-oxomethyl]-2,6-dimethyl-3-pyridinecarboxylic acid IUPAC Name: 4-(3-chlorophenyl)-5-(4-hydroxypiperidine-1-carbonyl)-2,6-dimethylpyridine-3-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-5-(4-hydroxypiperidine-1-carbonyl)-2,6-dimethyl-nicotinic acid Formula: C20H21ClN2O4 MolecularWeight: 388.84474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C)C(=O)N2CCC(CC2)O)C3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C(=N1)C)C(=O)N2CCC(CC2)O)C3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C20H21ClN2O4/c1-11-16(19(25)23-8-6-15(24)7-9-23)18(13-4-3-5-14(21)10-13)17(20(26)27)12(2)22-11/h3-5,10,15,24H,6-9H2,1-2H3,(H,26,27)