2-(2-methylphenyl)-1-oxidanylidene-2,4-diaza-5-azoniaspiro[4.5]dec-3-en-3-olate

Systemtic Name: 2-(2-methylphenyl)-1-oxidanylidene-2,4-diaza-5-azoniaspiro[4.5]dec-3-en-3-olate Openeye Name: 2-(o-tolyl)-1-oxo-2,4-diaza-5-azoniaspiro[4.5]dec-3-en-3-olate CAS Name: 2-(2-methylphenyl)-1-oxo-2,4-diaza-5-azoniaspiro[4.5]dec-3-en-3-olate IUPAC Name: 2-(2-methylphenyl)-1-oxo-2,4-diaza-5-azoniaspiro[4.5]dec-3-en-3-olate Traditional Name: 1-keto-2-(o-tolyl)-2,4-diaza-5-azoniaspiro[4.5]dec-3-en-3-olate Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=N[N+]3(C2=O)CCCCC3)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=N[N+]3(C2=O)CCCCC3)[O-]

InChI

InChI=1S/C14H17N3O2/c1-11-7-3-4-8-12(11)16-13(18)15-17(14(16)19)9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-10H2,1H3