[1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methoxyquinoline-2-carboxylate

Systemtic Name: [1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methoxyquinoline-2-carboxylate Openeye Name: [2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] 6-methoxyquinoline-2-carboxylate CAS Name: 6-methoxy-2-quinolinecarboxylic acid [1-(3-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-cyanoanilino)-1-oxopropan-2-yl] 6-methoxyquinoline-2-carboxylate Traditional Name: 6-methoxyquinaldic acid [2-(3-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)OC(=O)C2=NC3=C(C=C2)C=C(C=C3)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C#N)OC(=O)C2=NC3=C(C=C2)C=C(C=C3)OC

InChI

InChI=1S/C21H17N3O4/c1-13(20(25)23-16-5-3-4-14(10-16)12-22)28-21(26)19-8-6-15-11-17(27-2)7-9-18(15)24-19/h3-11,13H,1-2H3,(H,23,25)