methyl-[(2-methylphenyl)methyl]-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]azanium

Systemtic Name: methyl-[(2-methylphenyl)methyl]-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]azanium Openeye Name: methyl-[(5-nitro-2-oxo-1-pyridyl)methyl]-(o-tolylmethyl)ammonium CAS Name: methyl-[(2-methylphenyl)methyl]-[(5-nitro-2-oxo-1-pyridinyl)methyl]ammonium IUPAC Name: methyl-[(2-methylphenyl)methyl]-[(5-nitro-2-oxopyridin-1-yl)methyl]azanium Traditional Name: (2-keto-5-nitro-1-pyridyl)methyl-methyl-(2-methylbenzyl)ammonium Formula: C15H18N3O3+ MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](C)CN2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C[NH+](C)CN2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O3/c1-12-5-3-4-6-13(12)9-16(2)11-17-10-14(18(20)21)7-8-15(17)19/h3-8,10H,9,11H2,1-2H3/p+1