(2-chloranylquinolin-3-yl)methyl 3-[(2-methylphenyl)carbonylamino]propanoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 3-[(2-methylphenyl)carbonylamino]propanoate Openeye Name: (2-chloro-3-quinolyl)methyl 3-[(2-methylbenzoyl)amino]propanoate CAS Name: 3-[[(2-methylphenyl)-oxomethyl]amino]propanoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 3-[(2-methylbenzoyl)amino]propanoate Traditional Name: 3-(o-toluoylamino)propionic acid (2-chloro-3-quinolyl)methyl ester Formula: C21H19ClN2O3 MolecularWeight: 382.84016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)OCC2=CC3=CC=CC=C3N=C2Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)OCC2=CC3=CC=CC=C3N=C2Cl

InChI

InChI=1S/C21H19ClN2O3/c1-14-6-2-4-8-17(14)21(26)23-11-10-19(25)27-13-16-12-15-7-3-5-9-18(15)24-20(16)22/h2-9,12H,10-11,13H2,1H3,(H,23,26)