ethyl 5-cyano-2-methyl-6-[4-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-[4-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-(2-anilino-2-oxo-ethyl)-1-piperidyl]-5-cyano-2-methyl-pyridine-3-carboxylate CAS Name: 6-[4-(2-anilino-2-oxoethyl)-1-piperidinyl]-5-cyano-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(2-anilino-2-oxoethyl)piperidin-1-yl]-5-cyano-2-methylpyridine-3-carboxylate Traditional Name: 6-[4-(2-anilino-2-keto-ethyl)piperidino]-5-cyano-2-methyl-nicotinic acid ethyl ester Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(CC2)CC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(CC2)CC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C23H26N4O3/c1-3-30-23(29)20-14-18(15-24)22(25-16(20)2)27-11-9-17(10-12-27)13-21(28)26-19-7-5-4-6-8-19/h4-8,14,17H,3,9-13H2,1-2H3,(H,26,28)