(2,3-dimethoxyphenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (2,3-dimethoxyphenyl)methyl-methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (2,3-dimethoxyphenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: (2,3-dimethoxyphenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (2,3-dimethoxyphenyl)methyl-methyl-[2-(4-nitroanilino)-2-oxoethyl]azanium Traditional Name: [2-keto-2-(4-nitroanilino)ethyl]-methyl-o-veratryl-ammonium Formula: C18H22N3O5+ MolecularWeight: 360.38438

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O5/c1-20(11-13-5-4-6-16(25-2)18(13)26-3)12-17(22)19-14-7-9-15(10-8-14)21(23)24/h4-10H,11-12H2,1-3H3,(H,19,22)/p+1