3-[2-[(Z)-C-methyl-N-(phenylsulfonyloxy)carbonimidoyl]phenyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[2-[(Z)-C-methyl-N-(phenylsulfonyloxy)carbonimidoyl]phenyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[2-[(Z)-N-(benzenesulfonyloxy)-C-methyl-carbonimidoyl]phenyl]oxadiazol-3-ium-5-olate CAS Name: 3-[2-[(1Z)-1-(benzenesulfonyloxyimino)ethyl]phenyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[2-[(Z)-N-(benzenesulfonyloxy)-C-methylcarbonimidoyl]phenyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[2-[(Z)-N-besyloxy-C-methyl-carbonimidoyl]phenyl]oxadiazol-3-ium-5-olate Formula: C16H13N3O5S MolecularWeight: 359.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOS(=O)(=O)C1=CC=CC=C1)C2=CC=CC=C2[N+]3=NOC(=C3)[O-]

Isomeric SMILES

C/C(=N/OS(=O)(=O)C1=CC=CC=C1)/C2=CC=CC=C2[N+]3=NOC(=C3)[O-]

InChI

InChI=1S/C16H13N3O5S/c1-12(17-24-25(21,22)13-7-3-2-4-8-13)14-9-5-6-10-15(14)19-11-16(20)23-18-19/h2-11H,1H3/b17-12-