methyl 3-[(2,6-dimethylquinolin-4-yl)carbonylamino]-4-fluoranyl-benzoate

Systemtic Name: methyl 3-[(2,6-dimethylquinolin-4-yl)carbonylamino]-4-fluoranyl-benzoate Openeye Name: methyl 3-[(2,6-dimethylquinoline-4-carbonyl)amino]-4-fluoro-benzoate CAS Name: 3-[[(2,6-dimethyl-4-quinolinyl)-oxomethyl]amino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 3-[(2,6-dimethylquinoline-4-carbonyl)amino]-4-fluorobenzoate Traditional Name: 3-[(2,6-dimethylquinoline-4-carbonyl)amino]-4-fluoro-benzoic acid methyl ester Formula: C20H17FN2O3 MolecularWeight: 352.358983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(C=CC(=C3)C(=O)OC)F)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(C=CC(=C3)C(=O)OC)F)C

InChI

InChI=1S/C20H17FN2O3/c1-11-4-7-17-14(8-11)15(9-12(2)22-17)19(24)23-18-10-13(20(25)26-3)5-6-16(18)21/h4-10H,1-3H3,(H,23,24)