[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 4-oxidanylidene-1H-quinoline-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 4-oxidanylidene-1H-quinoline-2-carboxylate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 4-oxo-1H-quinoline-2-carboxylate CAS Name: 4-oxo-1H-quinoline-2-carboxylic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 4-oxo-1H-quinoline-2-carboxylate Traditional Name: 4-keto-1H-quinoline-2-carboxylic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)C1=CC(=O)C2=CC=CC=C2N1)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)C1=CC(=O)C2=CC=CC=C2N1)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O4/c1-14(15-7-3-2-4-8-15)12-22-20(25)13-27-21(26)18-11-19(24)16-9-5-6-10-17(16)23-18/h2-11,14H,12-13H2,1H3,(H,22,25)(H,23,24)/t14-/m1/s1