(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl 2-[(4-fluorophenyl)carbonylamino]ethanoate

Systemtic Name: (2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl 2-[(4-fluorophenyl)carbonylamino]ethanoate Openeye Name: (2-chloro-7,8-dimethyl-3-quinolyl)methyl 2-[(4-fluorobenzoyl)amino]acetate CAS Name: 2-[[(4-fluorophenyl)-oxomethyl]amino]acetic acid (2-chloro-7,8-dimethyl-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7,8-dimethylquinolin-3-yl)methyl 2-[(4-fluorobenzoyl)amino]acetate Traditional Name: 2-[(4-fluorobenzoyl)amino]acetic acid (2-chloro-7,8-dimethyl-3-quinolyl)methyl ester Formula: C21H18ClFN2O3 MolecularWeight: 400.830623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)COC(=O)CNC(=O)C3=CC=C(C=C3)F)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)COC(=O)CNC(=O)C3=CC=C(C=C3)F)Cl)C

InChI

InChI=1S/C21H18ClFN2O3/c1-12-3-4-15-9-16(20(22)25-19(15)13(12)2)11-28-18(26)10-24-21(27)14-5-7-17(23)8-6-14/h3-9H,10-11H2,1-2H3,(H,24,27)