2-benzamido-3-(carboxymethylamino)-3-oxidanylidene-2-(phenyldisulfanyl)propanoic acid

Systemtic Name: 2-benzamido-3-(carboxymethylamino)-3-oxidanylidene-2-(phenyldisulfanyl)propanoic acid Openeye Name: 2-benzamido-3-(carboxymethylamino)-3-oxo-2-(phenyldisulfanyl)propanoic acid CAS Name: 2-benzamido-3-(carboxymethylamino)-3-oxo-2-(phenyldisulfanyl)propanoic acid IUPAC Name: 2-benzamido-3-(carboxymethylamino)-3-oxo-2-(phenyldisulfanyl)propanoic acid Traditional Name: 2-benzamido-3-(carboxymethylamino)-3-keto-2-(phenyldisulfanyl)propionic acid Formula: C18H16N2O6S2 MolecularWeight: 420.45944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(C(=O)NCC(=O)O)(C(=O)O)SSC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(C(=O)NCC(=O)O)(C(=O)O)SSC2=CC=CC=C2

InChI

InChI=1S/C18H16N2O6S2/c21-14(22)11-19-16(24)18(17(25)26,28-27-13-9-5-2-6-10-13)20-15(23)12-7-3-1-4-8-12/h1-10H,11H2,(H,19,24)(H,20,23)(H,21,22)(H,25,26)