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

Systemtic Name: (3S)-2-oxidanylidene-3-[(2-oxidanyl-2-phenyl-ethanoyl)amino]azetidine-1-sulfonic acid Openeye Name: (3S)-3-[(2-hydroxy-2-phenyl-acetyl)amino]-2-oxo-azetidine-1-sulfonic acid CAS Name: (3S)-3-[(2-hydroxy-1-oxo-2-phenylethyl)amino]-2-oxo-1-azetidinesulfonic acid IUPAC Name: (3S)-3-[(2-hydroxy-2-phenylacetyl)amino]-2-oxoazetidine-1-sulfonic acid Traditional Name: (3S)-2-keto-3-(mandeloylamino)azetidine-1-sulfonic acid Formula: C11H12N2O6S MolecularWeight: 300.28778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1[C@@H](C(=O)N1S(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)O

InChI

InChI=1S/C11H12N2O6S/c14-9(7-4-2-1-3-5-7)10(15)12-8-6-13(11(8)16)20(17,18)19/h1-5,8-9,14H,6H2,(H,12,15)(H,17,18,19)/t8-,9?/m0/s1