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

Systemtic Name: 3-methoxy-2-oxidanylidene-3-(2-phenylethanoylamino)azetidine-1-sulfonic acid Openeye Name: 3-methoxy-2-oxo-3-[(2-phenylacetyl)amino]azetidine-1-sulfonic acid CAS Name: 3-methoxy-2-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinesulfonic acid IUPAC Name: 3-methoxy-2-oxo-3-[(2-phenylacetyl)amino]azetidine-1-sulfonic acid Traditional Name: 2-keto-3-methoxy-3-[(2-phenylacetyl)amino]azetidine-1-sulfonic acid Formula: C12H14N2O6S MolecularWeight: 314.31436

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CN(C1=O)S(=O)(=O)O)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

COC1(CN(C1=O)S(=O)(=O)O)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C12H14N2O6S/c1-20-12(8-14(11(12)16)21(17,18)19)13-10(15)7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,13,15)(H,17,18,19)