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

Systemtic Name: 3-[(2-azido-2-phenyl-ethanoyl)amino]-3-methoxy-2-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[(2-azido-2-phenyl-acetyl)amino]-3-methoxy-2-oxo-azetidine-1-sulfonic acid CAS Name: 3-[(2-azido-1-oxo-2-phenylethyl)amino]-3-methoxy-2-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[(2-azido-2-phenylacetyl)amino]-3-methoxy-2-oxoazetidine-1-sulfonic acid Traditional Name: 3-[(2-azido-2-phenyl-acetyl)amino]-2-keto-3-methoxy-azetidine-1-sulfonic acid Formula: C12H13N5O6S MolecularWeight: 355.32652

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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=[N+]=[N-]

Isomeric SMILES

COC1(CN(C1=O)S(=O)(=O)O)NC(=O)C(C2=CC=CC=C2)N=[N+]=[N-]

InChI

InChI=1S/C12H13N5O6S/c1-23-12(7-17(11(12)19)24(20,21)22)14-10(18)9(15-16-13)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3,(H,14,18)(H,20,21,22)