(2-chloranylquinolin-3-yl)methyl (2R)-3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl (2R)-3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate Openeye Name: (2-chloro-3-quinolyl)methyl (2R)-3-methyl-2-(thiophene-2-carbonylamino)butanoate CAS Name: (2R)-3-methyl-2-[[oxo(thiophen-2-yl)methyl]amino]butanoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl (2R)-3-methyl-2-(thiophene-2-carbonylamino)butanoate Traditional Name: (2R)-3-methyl-2-(2-thenoylamino)butyric acid (2-chloro-3-quinolyl)methyl ester Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC2=CC=CC=C2N=C1Cl)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)[C@H](C(=O)OCC1=CC2=CC=CC=C2N=C1Cl)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H19ClN2O3S/c1-12(2)17(23-19(24)16-8-5-9-27-16)20(25)26-11-14-10-13-6-3-4-7-15(13)22-18(14)21/h3-10,12,17H,11H2,1-2H3,(H,23,24)/t17-/m1/s1