[2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)amino]pyridine-3-carboxylate

Systemtic Name: [2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)amino]pyridine-3-carboxylate Openeye Name: [2-[benzyl(ethyl)amino]-2-oxo-ethyl] 2-(4-ethoxyanilino)pyridine-3-carboxylate CAS Name: 2-(4-ethoxyanilino)-3-pyridinecarboxylic acid [2-[ethyl-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[benzyl(ethyl)amino]-2-oxoethyl] 2-(4-ethoxyanilino)pyridine-3-carboxylate Traditional Name: 2-(p-phenetidino)nicotinic acid [2-[benzyl(ethyl)amino]-2-keto-ethyl] ester Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)COC(=O)C2=C(N=CC=C2)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)COC(=O)C2=C(N=CC=C2)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C25H27N3O4/c1-3-28(17-19-9-6-5-7-10-19)23(29)18-32-25(30)22-11-8-16-26-24(22)27-20-12-14-21(15-13-20)31-4-2/h5-16H,3-4,17-18H2,1-2H3,(H,26,27)