[(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl] 2-methylquinoline-4-carboxylate

Systemtic Name: [(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl] 2-methylquinoline-4-carboxylate Openeye Name: [(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl] 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [(1S)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: [(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl] 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [(1S)-2-keto-1-phenyl-2-pyrrolidino-ethyl] ester Formula: C23H22N2O3 MolecularWeight: 374.43238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OC(C3=CC=CC=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)O[C@@H](C3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C23H22N2O3/c1-16-15-19(18-11-5-6-12-20(18)24-16)23(27)28-21(17-9-3-2-4-10-17)22(26)25-13-7-8-14-25/h2-6,9-12,15,21H,7-8,13-14H2,1H3/t21-/m0/s1