[2-oxidanylidene-2-[(4-phenylazanylphenyl)-propan-2-yl-amino]ethyl] 2-ethoxypyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-phenylazanylphenyl)-propan-2-yl-amino]ethyl] 2-ethoxypyridine-3-carboxylate Openeye Name: [2-(4-anilino-N-isopropyl-anilino)-2-oxo-ethyl] 2-ethoxypyridine-3-carboxylate CAS Name: 2-ethoxy-3-pyridinecarboxylic acid [2-(4-anilino-N-propan-2-ylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-anilino-N-propan-2-ylanilino)-2-oxoethyl] 2-ethoxypyridine-3-carboxylate Traditional Name: 2-ethoxynicotinic acid [2-(4-anilino-N-isopropyl-anilino)-2-keto-ethyl] ester Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)OCC(=O)N(C2=CC=C(C=C2)NC3=CC=CC=C3)C(C)C

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)OCC(=O)N(C2=CC=C(C=C2)NC3=CC=CC=C3)C(C)C

InChI

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