[2-[1-cyclopropylethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2,4-dimethylquinoline-3-carboxylate

Systemtic Name: [2-[1-cyclopropylethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2,4-dimethylquinoline-3-carboxylate Openeye Name: [2-[benzyl(1-cyclopropylethyl)amino]-2-oxo-ethyl] 2,4-dimethylquinoline-3-carboxylate CAS Name: 2,4-dimethyl-3-quinolinecarboxylic acid [2-[1-cyclopropylethyl-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl] 2,4-dimethylquinoline-3-carboxylate Traditional Name: 2,4-dimethylquinoline-3-carboxylic acid [2-[benzyl(1-cyclopropylethyl)amino]-2-keto-ethyl] ester Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C)C(=O)OCC(=O)N(CC3=CC=CC=C3)C(C)C4CC4

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C)C(=O)OCC(=O)N(CC3=CC=CC=C3)C(C)C4CC4

InChI

InChI=1S/C26H28N2O3/c1-17-22-11-7-8-12-23(22)27-18(2)25(17)26(30)31-16-24(29)28(19(3)21-13-14-21)15-20-9-5-4-6-10-20/h4-12,19,21H,13-16H2,1-3H3