[1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-ethyl-4-methyl-quinoline-3-carboxylate

Systemtic Name: [1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-ethyl-4-methyl-quinoline-3-carboxylate Openeye Name: [1-methyl-2-(4-morpholinoanilino)-2-oxo-ethyl] 2-ethyl-4-methyl-quinoline-3-carboxylate CAS Name: 2-ethyl-4-methyl-3-quinolinecarboxylic acid [1-[4-(4-morpholinyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl] 2-ethyl-4-methylquinoline-3-carboxylate Traditional Name: 2-ethyl-4-methyl-quinoline-3-carboxylic acid [2-keto-1-methyl-2-(4-morpholinoanilino)ethyl] ester Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C(=O)OC(C)C(=O)NC3=CC=C(C=C3)N4CCOCC4)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C(=O)OC(C)C(=O)NC3=CC=C(C=C3)N4CCOCC4)C

InChI

InChI=1S/C26H29N3O4/c1-4-22-24(17(2)21-7-5-6-8-23(21)28-22)26(31)33-18(3)25(30)27-19-9-11-20(12-10-19)29-13-15-32-16-14-29/h5-12,18H,4,13-16H2,1-3H3,(H,27,30)