[(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 2-oxidanylidene-1H-quinoline-4-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 2-oxidanylidene-1H-quinoline-4-carboxylate Openeye Name: [(1S)-1-(benzylcarbamoyl)propyl] 2-oxo-1H-quinoline-4-carboxylate CAS Name: 2-oxo-1H-quinoline-4-carboxylic acid [(2S)-1-oxo-1-[(phenylmethyl)amino]butan-2-yl] ester IUPAC Name: [(2S)-1-(benzylamino)-1-oxobutan-2-yl] 2-oxo-1H-quinoline-4-carboxylate Traditional Name: 2-keto-1H-quinoline-4-carboxylic acid [(1S)-1-(benzylcarbamoyl)propyl] ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC(=O)NC3=CC=CC=C32

Isomeric SMILES

CC[C@@H](C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC(=O)NC3=CC=CC=C32

InChI

InChI=1S/C21H20N2O4/c1-2-18(20(25)22-13-14-8-4-3-5-9-14)27-21(26)16-12-19(24)23-17-11-7-6-10-15(16)17/h3-12,18H,2,13H2,1H3,(H,22,25)(H,23,24)/t18-/m0/s1