[2-[3-[methyl(phenyl)amino]propylamino]-2-oxidanylidene-ethyl] 2-cyclopropylquinoline-4-carboxylate

Systemtic Name: [2-[3-[methyl(phenyl)amino]propylamino]-2-oxidanylidene-ethyl] 2-cyclopropylquinoline-4-carboxylate Openeye Name: [2-[3-(N-methylanilino)propylamino]-2-oxo-ethyl] 2-cyclopropylquinoline-4-carboxylate CAS Name: 2-cyclopropyl-4-quinolinecarboxylic acid [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] ester IUPAC Name: [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 2-cyclopropylquinoline-4-carboxylate Traditional Name: 2-cyclopropylcinchoninic acid [2-keto-2-[3-(N-methylanilino)propylamino]ethyl] ester Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3CC3)C4=CC=CC=C4

Isomeric SMILES

CN(CCCNC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O3/c1-28(19-8-3-2-4-9-19)15-7-14-26-24(29)17-31-25(30)21-16-23(18-12-13-18)27-22-11-6-5-10-20(21)22/h2-6,8-11,16,18H,7,12-15,17H2,1H3,(H,26,29)