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

Systemtic Name: (2-chloranylquinolin-3-yl)methyl (2S)-2-[(3-methylphenyl)carbonylamino]propanoate Openeye Name: (2-chloro-3-quinolyl)methyl (2S)-2-[(3-methylbenzoyl)amino]propanoate CAS Name: (2S)-2-[[(3-methylphenyl)-oxomethyl]amino]propanoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl (2S)-2-[(3-methylbenzoyl)amino]propanoate Traditional Name: (2S)-2-(m-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(=C1)C(=O)NC(C)C(=O)OCC2=CC3=CC=CC=C3N=C2Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C)C(=O)OCC2=CC3=CC=CC=C3N=C2Cl

InChI

InChI=1S/C21H19ClN2O3/c1-13-6-5-8-16(10-13)20(25)23-14(2)21(26)27-12-17-11-15-7-3-4-9-18(15)24-19(17)22/h3-11,14H,12H2,1-2H3,(H,23,25)/t14-/m0/s1