(2-chloranyl-7-methyl-quinolin-3-yl)methyl 2-[(4-bromophenyl)carbonylamino]ethanoate

Systemtic Name: (2-chloranyl-7-methyl-quinolin-3-yl)methyl 2-[(4-bromophenyl)carbonylamino]ethanoate Openeye Name: (2-chloro-7-methyl-3-quinolyl)methyl 2-[(4-bromobenzoyl)amino]acetate CAS Name: 2-[[(4-bromophenyl)-oxomethyl]amino]acetic acid (2-chloro-7-methyl-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methylquinolin-3-yl)methyl 2-[(4-bromobenzoyl)amino]acetate Traditional Name: 2-[(4-bromobenzoyl)amino]acetic acid (2-chloro-7-methyl-3-quinolyl)methyl ester Formula: C20H16BrClN2O3 MolecularWeight: 447.70964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)COC(=O)CNC(=O)C3=CC=C(C=C3)Br)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)COC(=O)CNC(=O)C3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C20H16BrClN2O3/c1-12-2-3-14-9-15(19(22)24-17(14)8-12)11-27-18(25)10-23-20(26)13-4-6-16(21)7-5-13/h2-9H,10-11H2,1H3,(H,23,26)