methyl (2S)-2-[(7-fluoranyl-2-methyl-quinolin-3-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(7-fluoranyl-2-methyl-quinolin-3-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(7-fluoro-2-methyl-quinoline-3-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(7-fluoro-2-methyl-3-quinolinyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(7-fluoro-2-methylquinoline-3-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(7-fluoro-2-methyl-quinoline-3-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C21H19FN2O3 MolecularWeight: 366.385563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H19FN2O3/c1-13-17(11-15-8-9-16(22)12-18(15)23-13)20(25)24-19(21(26)27-2)10-14-6-4-3-5-7-14/h3-9,11-12,19H,10H2,1-2H3,(H,24,25)/t19-/m0/s1