[(2R)-1-(methylamino)-1-oxidanylidene-propan-2-yl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [(2R)-1-(methylamino)-1-oxidanylidene-propan-2-yl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [(1R)-1-methyl-2-(methylamino)-2-oxo-ethyl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [(2R)-1-(methylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(methylamino)-1-oxopropan-2-yl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [(1R)-2-keto-1-methyl-2-(methylamino)ethyl] ester Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)OC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

C[C@H](C(=O)NC)OC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C13H12ClNO3S/c1-7(12(16)15-2)18-13(17)11-10(14)8-5-3-4-6-9(8)19-11/h3-7H,1-2H3,(H,15,16)/t7-/m1/s1