(1-azanyl-1-oxidanylidene-propan-2-yl) 2-chloranyl-5-methylsulfanyl-benzoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 2-chloranyl-5-methylsulfanyl-benzoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 2-chloro-5-methylsulfanyl-benzoate CAS Name: 2-chloro-5-(methylthio)benzoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 2-chloro-5-methylsulfanylbenzoate Traditional Name: 2-chloro-5-(methylthio)benzoic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C11H12ClNO3S MolecularWeight: 273.73588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=C(C=CC(=C1)SC)Cl

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=C(C=CC(=C1)SC)Cl

InChI

InChI=1S/C11H12ClNO3S/c1-6(10(13)14)16-11(15)8-5-7(17-2)3-4-9(8)12/h3-6H,1-2H3,(H2,13,14)