2-methoxycarbonyl-4-oxidanylidene-3-[(2-oxidanyl-2-phenyl-ethanoyl)amino]azetidine-1-sulfonic acid

Systemtic Name: 2-methoxycarbonyl-4-oxidanylidene-3-[(2-oxidanyl-2-phenyl-ethanoyl)amino]azetidine-1-sulfonic acid Openeye Name: 3-[(2-hydroxy-2-phenyl-acetyl)amino]-2-methoxycarbonyl-4-oxo-azetidine-1-sulfonic acid CAS Name: 3-[(2-hydroxy-1-oxo-2-phenylethyl)amino]-2-methoxycarbonyl-4-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[(2-hydroxy-2-phenylacetyl)amino]-2-methoxycarbonyl-4-oxoazetidine-1-sulfonic acid Traditional Name: 2-carbomethoxy-4-keto-3-(mandeloylamino)azetidine-1-sulfonic acid Formula: C13H14N2O8S MolecularWeight: 358.32386

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)O

Isomeric SMILES

COC(=O)C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)O

InChI

InChI=1S/C13H14N2O8S/c1-23-13(19)9-8(12(18)15(9)24(20,21)22)14-11(17)10(16)7-5-3-2-4-6-7/h2-6,8-10,16H,1H3,(H,14,17)(H,20,21,22)