(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]azanium

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]azanium Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(5-nitro-2-oxo-1-pyridyl)methyl]ammonium CAS Name: (4,5-dimethoxy-2-methylphenyl)methyl-methyl-[(5-nitro-2-oxo-1-pyridinyl)methyl]ammonium IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl-methyl-[(5-nitro-2-oxopyridin-1-yl)methyl]azanium Traditional Name: (4,5-dimethoxy-2-methyl-benzyl)-[(2-keto-5-nitro-1-pyridyl)methyl]-methyl-ammonium Formula: C17H22N3O5+ MolecularWeight: 348.37368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O5/c1-12-7-15(24-3)16(25-4)8-13(12)9-18(2)11-19-10-14(20(22)23)5-6-17(19)21/h5-8,10H,9,11H2,1-4H3/p+1