[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 7-fluoranyl-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 7-fluoranyl-2-oxidanylidene-3,4-dihydro-1H-quinoline-4-carboxylate Openeye Name: [2-[benzyl(phenethyl)amino]-2-oxo-ethyl] 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate CAS Name: 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylic acid [2-oxo-2-[phenethyl-(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-[benzyl(phenethyl)amino]-2-oxoethyl] 7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-4-carboxylate Traditional Name: 7-fluoro-2-keto-3,4-dihydro-1H-quinoline-4-carboxylic acid [2-[benzyl(phenethyl)amino]-2-keto-ethyl] ester Formula: C27H25FN2O4 MolecularWeight: 460.496803

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=C(C=C2)F)NC1=O)C(=O)OCC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C(C2=C(C=C(C=C2)F)NC1=O)C(=O)OCC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H25FN2O4/c28-21-11-12-22-23(16-25(31)29-24(22)15-21)27(33)34-18-26(32)30(17-20-9-5-2-6-10-20)14-13-19-7-3-1-4-8-19/h1-12,15,23H,13-14,16-18H2,(H,29,31)