3-[2-[(Z)-C-methyl-N-(4-methylphenyl)sulfonyloxy-carbonimidoyl]phenyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[2-[(Z)-C-methyl-N-(4-methylphenyl)sulfonyloxy-carbonimidoyl]phenyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[2-[(Z)-C-methyl-N-(p-tolylsulfonyloxy)carbonimidoyl]phenyl]oxadiazol-3-ium-5-olate CAS Name: 3-[2-[(1Z)-1-(4-methylphenyl)sulfonyloxyiminoethyl]phenyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[2-[(Z)-C-methyl-N-(4-methylphenyl)sulfonyloxycarbonimidoyl]phenyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[2-[(Z)-C-methyl-N-tosyloxy-carbonimidoyl]phenyl]oxadiazol-3-ium-5-olate Formula: C17H15N3O5S MolecularWeight: 373.3831

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON=C(C)C2=CC=CC=C2[N+]3=NOC(=C3)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/N=C(/C)\C2=CC=CC=C2[N+]3=NOC(=C3)[O-]

InChI

InChI=1S/C17H15N3O5S/c1-12-7-9-14(10-8-12)26(22,23)25-18-13(2)15-5-3-4-6-16(15)20-11-17(21)24-19-20/h3-11H,1-2H3/b18-13-