(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(2,5-dimethylanilino)-2-oxo-ethyl]-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-methyl-ammonium CAS Name: [2-(2,5-dimethylanilino)-2-oxoethyl]-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-methylammonium IUPAC Name: [2-(2,5-dimethylanilino)-2-oxoethyl]-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-methylazanium Traditional Name: [2-(2,5-dimethylanilino)-2-keto-ethyl]-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-methyl-ammonium Formula: C17H24N5O3+ MolecularWeight: 346.40416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C[NH+](C)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C[NH+](C)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C17H23N5O3/c1-11-6-7-12(2)15(8-11)18-16(23)9-20(5)10-21-14(4)17(22(24)25)13(3)19-21/h6-8H,9-10H2,1-5H3,(H,18,23)/p+1