[1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methoxy-2-methyl-quinoline-3-carboxylate

Systemtic Name: [1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methoxy-2-methyl-quinoline-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2-sec-butylanilino)ethyl] 6-methoxy-2-methyl-quinoline-3-carboxylate CAS Name: 6-methoxy-2-methyl-3-quinolinecarboxylic acid [1-(2-butan-2-ylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-butan-2-ylanilino)-1-oxopropan-2-yl] 6-methoxy-2-methylquinoline-3-carboxylate Traditional Name: 6-methoxy-2-methyl-quinoline-3-carboxylic acid [2-keto-1-methyl-2-(2-sec-butylanilino)ethyl] ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)OC(=O)C2=C(N=C3C=CC(=CC3=C2)OC)C

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)OC(=O)C2=C(N=C3C=CC(=CC3=C2)OC)C

InChI

InChI=1S/C25H28N2O4/c1-6-15(2)20-9-7-8-10-23(20)27-24(28)17(4)31-25(29)21-14-18-13-19(30-5)11-12-22(18)26-16(21)3/h7-15,17H,6H2,1-5H3,(H,27,28)