6-[4-(dimethylamino)cyclohexyl]-1-(2-methyl-4-oxidanyl-phenyl)-4-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 6-[4-(dimethylamino)cyclohexyl]-1-(2-methyl-4-oxidanyl-phenyl)-4-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 6-[4-(dimethylamino)cyclohexyl]-1-(4-hydroxy-2-methyl-phenyl)-4-oxo-pyridine-3-carboxylic acid CAS Name: 6-[4-(dimethylamino)cyclohexyl]-1-(4-hydroxy-2-methylphenyl)-4-oxo-3-pyridinecarboxylic acid IUPAC Name: 6-[4-(dimethylamino)cyclohexyl]-1-(4-hydroxy-2-methylphenyl)-4-oxopyridine-3-carboxylic acid Traditional Name: 6-[4-(dimethylamino)cyclohexyl]-1-(4-hydroxy-2-methyl-phenyl)-4-keto-nicotinic acid Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)N2C=C(C(=O)C=C2C3CCC(CC3)N(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)O)N2C=C(C(=O)C=C2C3CCC(CC3)N(C)C)C(=O)O

InChI

InChI=1S/C21H26N2O4/c1-13-10-16(24)8-9-18(13)23-12-17(21(26)27)20(25)11-19(23)14-4-6-15(7-5-14)22(2)3/h8-12,14-15,24H,4-7H2,1-3H3,(H,26,27)