3-methoxy-2-methyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidine-1-sulfonic acid

Systemtic Name: 3-methoxy-2-methyl-4-oxidanylidene-3-(2-phenylethanoylamino)azetidine-1-sulfonic acid Openeye Name: 3-methoxy-2-methyl-4-oxo-3-[(2-phenylacetyl)amino]azetidine-1-sulfonic acid CAS Name: 3-methoxy-2-methyl-4-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinesulfonic acid IUPAC Name: 3-methoxy-2-methyl-4-oxo-3-[(2-phenylacetyl)amino]azetidine-1-sulfonic acid Traditional Name: 2-keto-3-methoxy-4-methyl-3-[(2-phenylacetyl)amino]azetidine-1-sulfonic acid Formula: C13H16N2O6S MolecularWeight: 328.34094

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N1S(=O)(=O)O)(NC(=O)CC2=CC=CC=C2)OC

Isomeric SMILES

CC1C(C(=O)N1S(=O)(=O)O)(NC(=O)CC2=CC=CC=C2)OC

InChI

InChI=1S/C13H16N2O6S/c1-9-13(21-2,12(17)15(9)22(18,19)20)14-11(16)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,14,16)(H,18,19,20)