[3-[(2-azanyl-2-phenyl-ethanoyl)amino]-2-methyl-4-oxidanylidene-azetidin-1-yl]oxymethanesulfonic acid

Systemtic Name: [3-[(2-azanyl-2-phenyl-ethanoyl)amino]-2-methyl-4-oxidanylidene-azetidin-1-yl]oxymethanesulfonic acid Openeye Name: [3-[(2-amino-2-phenyl-acetyl)amino]-2-methyl-4-oxo-azetidin-1-yl]oxymethanesulfonic acid CAS Name: [3-[(2-amino-1-oxo-2-phenylethyl)amino]-2-methyl-4-oxo-1-azetidinyl]oxymethanesulfonic acid IUPAC Name: [3-[(2-amino-2-phenylacetyl)amino]-2-methyl-4-oxoazetidin-1-yl]oxymethanesulfonic acid Traditional Name: [3-[(2-amino-2-phenyl-acetyl)amino]-2-keto-4-methyl-azetidin-1-yl]oxymethanesulfonic acid Formula: C13H17N3O6S MolecularWeight: 343.35558

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N1OCS(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)N

Isomeric SMILES

CC1C(C(=O)N1OCS(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)N

InChI

InChI=1S/C13H17N3O6S/c1-8-11(13(18)16(8)22-7-23(19,20)21)15-12(17)10(14)9-5-3-2-4-6-9/h2-6,8,10-11H,7,14H2,1H3,(H,15,17)(H,19,20,21)