3-[(4-methylphenyl)methyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[(4-methylphenyl)methyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(p-tolylmethyl)oxadiazol-3-ium-5-olate CAS Name: 3-[(4-methylphenyl)methyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[(4-methylphenyl)methyl]oxadiazol-3-ium-5-olate Traditional Name: 3-(4-methylbenzyl)oxadiazol-3-ium-5-olate Formula: C10H10N2O2 MolecularWeight: 190.1986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=NOC(=C2)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=NOC(=C2)[O-]

InChI

InChI=1S/C10H10N2O2/c1-8-2-4-9(5-3-8)6-12-7-10(13)14-11-12/h2-5,7H,6H2,1H3