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

Systemtic Name: 3-[(3,4-dimethylphenyl)methyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[(3,4-dimethylphenyl)methyl]oxadiazol-3-ium-5-olate CAS Name: 3-[(3,4-dimethylphenyl)methyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[(3,4-dimethylphenyl)methyl]oxadiazol-3-ium-5-olate Traditional Name: 3-(3,4-dimethylbenzyl)oxadiazol-3-ium-5-olate Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O2/c1-8-3-4-10(5-9(8)2)6-13-7-11(14)15-12-13/h3-5,7H,6H2,1-2H3