2-[(S)-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfinyl]ethanoate

Systemtic Name: 2-[(S)-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfinyl]ethanoate Openeye Name: 2-[(S)-[2-(2-methylanilino)-2-oxo-ethyl]sulfinyl]acetate CAS Name: 2-[(S)-[2-(2-methylanilino)-2-oxoethyl]sulfinyl]acetate IUPAC Name: 2-[(S)-[2-(2-methylanilino)-2-oxoethyl]sulfinyl]acetate Traditional Name: 2-[(S)-[2-keto-2-(o-toluidino)ethyl]sulfinyl]acetate Formula: C11H12NO4S- MolecularWeight: 254.28228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CS(=O)CC(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C[S@](=O)CC(=O)[O-]

InChI

InChI=1S/C11H13NO4S/c1-8-4-2-3-5-9(8)12-10(13)6-17(16)7-11(14)15/h2-5H,6-7H2,1H3,(H,12,13)(H,14,15)/p-1/t17-/m0/s1