[2-oxidanylidene-2-(2-phenylpropylamino)ethyl] 2-methylquinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2-phenylpropylamino)ethyl] 2-methylquinoline-4-carboxylate Openeye Name: [2-oxo-2-(2-phenylpropylamino)ethyl] 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [2-oxo-2-(2-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylpropylamino)ethyl] 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [2-keto-2-(2-phenylpropylamino)ethyl] ester Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NCC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NCC(C)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O3/c1-15(17-8-4-3-5-9-17)13-23-21(25)14-27-22(26)19-12-16(2)24-20-11-7-6-10-18(19)20/h3-12,15H,13-14H2,1-2H3,(H,23,25)