3-[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoranyl-4-oxidanylidene-1H-quinolin-6-yl]propanoic acid

Systemtic Name: 3-[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoranyl-4-oxidanylidene-1H-quinolin-6-yl]propanoic acid Openeye Name: 3-[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoro-4-oxo-1H-quinolin-6-yl]propanoic acid CAS Name: 3-[3-[[(4-chlorophenyl)methylamino]-oxomethyl]-8-fluoro-4-oxo-1H-quinolin-6-yl]propanoic acid IUPAC Name: 3-[3-[(4-chlorophenyl)methylcarbamoyl]-8-fluoro-4-oxo-1H-quinolin-6-yl]propanoic acid Traditional Name: 3-[3-[(4-chlorobenzyl)carbamoyl]-8-fluoro-4-keto-1H-quinolin-6-yl]propionic acid Formula: C20H16ClFN2O4 MolecularWeight: 402.803443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C=C(C=C3C2=O)CCC(=O)O)F)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C=C(C=C3C2=O)CCC(=O)O)F)Cl

InChI

InChI=1S/C20H16ClFN2O4/c21-13-4-1-11(2-5-13)9-24-20(28)15-10-23-18-14(19(15)27)7-12(8-16(18)22)3-6-17(25)26/h1-2,4-5,7-8,10H,3,6,9H2,(H,23,27)(H,24,28)(H,25,26)