methyl 2-[2-[(7-fluoranyl-2-methyl-quinolin-3-yl)carbonyl-methyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(7-fluoranyl-2-methyl-quinolin-3-yl)carbonyl-methyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[(7-fluoro-2-methyl-quinoline-3-carbonyl)-methyl-amino]acetyl]amino]benzoate CAS Name: 2-[[2-[[(7-fluoro-2-methyl-3-quinolinyl)-oxomethyl]-methylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(7-fluoro-2-methylquinoline-3-carbonyl)-methylamino]acetyl]amino]benzoate Traditional Name: 2-[[2-[(7-fluoro-2-methyl-quinoline-3-carbonyl)-methyl-amino]acetyl]amino]benzoic acid methyl ester Formula: C22H20FN3O4 MolecularWeight: 409.410303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N(C)CC(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N(C)CC(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H20FN3O4/c1-13-17(10-14-8-9-15(23)11-19(14)24-13)21(28)26(2)12-20(27)25-18-7-5-4-6-16(18)22(29)30-3/h4-11H,12H2,1-3H3,(H,25,27)