3-[(2-azanyl-2-phenyl-ethanoyl)amino]-3-methoxy-2-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 3-[(2-azanyl-2-phenyl-ethanoyl)amino]-3-methoxy-2-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[(2-amino-2-phenyl-acetyl)amino]-3-methoxy-2-oxo-azetidine-1-sulfonic acid CAS Name: 3-[(2-amino-1-oxo-2-phenylethyl)amino]-3-methoxy-2-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[(2-amino-2-phenylacetyl)amino]-3-methoxy-2-oxoazetidine-1-sulfonic acid Traditional Name: 3-[(2-amino-2-phenyl-acetyl)amino]-2-keto-3-methoxy-azetidine-1-sulfonic acid Formula: C12H15N3O6S MolecularWeight: 329.329

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CN(C1=O)S(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)N

Isomeric SMILES

COC1(CN(C1=O)S(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)N

InChI

InChI=1S/C12H15N3O6S/c1-21-12(7-15(11(12)17)22(18,19)20)14-10(16)9(13)8-5-3-2-4-6-8/h2-6,9H,7,13H2,1H3,(H,14,16)(H,18,19,20)