2-azanyl-2-methoxy-5-(2-methylphenyl)-4-oxidanylidene-3-sulfanyl-hexanoic acid

Systemtic Name: 2-azanyl-2-methoxy-5-(2-methylphenyl)-4-oxidanylidene-3-sulfanyl-hexanoic acid Openeye Name: 2-amino-2-methoxy-5-(o-tolyl)-4-oxo-3-sulfanyl-hexanoic acid CAS Name: 2-amino-3-mercapto-2-methoxy-5-(2-methylphenyl)-4-oxohexanoic acid IUPAC Name: 2-amino-2-methoxy-5-(2-methylphenyl)-4-oxo-3-sulfanylhexanoic acid Traditional Name: 2-amino-4-keto-3-mercapto-2-methoxy-5-(o-tolyl)hexanoic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)C(=O)C(C(C(=O)O)(N)OC)S

Isomeric SMILES

CC1=CC=CC=C1C(C)C(=O)C(C(C(=O)O)(N)OC)S

InChI

InChI=1S/C14H19NO4S/c1-8-6-4-5-7-10(8)9(2)11(16)12(20)14(15,19-3)13(17)18/h4-7,9,12,20H,15H2,1-3H3,(H,17,18)