(1-azanyl-1-oxidanylidene-propan-2-yl) 2-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfanylbenzoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 2-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfanylbenzoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 2-(2-amino-1-methyl-2-oxo-ethyl)sulfanylbenzoate CAS Name: 2-[(1-amino-1-oxopropan-2-yl)thio]benzoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 2-(1-amino-1-oxopropan-2-yl)sulfanylbenzoate Traditional Name: 2-[(2-amino-2-keto-1-methyl-ethyl)thio]benzoic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC=CC=C1SC(C)C(=O)N

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=CC=CC=C1SC(C)C(=O)N

InChI

InChI=1S/C13H16N2O4S/c1-7(11(14)16)19-13(18)9-5-3-4-6-10(9)20-8(2)12(15)17/h3-8H,1-2H3,(H2,14,16)(H2,15,17)