(3-methoxyphenyl)methyl-methyl-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (3-methoxyphenyl)methyl-methyl-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (3-methoxyphenyl)methyl-methyl-[2-(2-methyl-5-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: (3-methoxyphenyl)methyl-methyl-[2-(2-methyl-5-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (3-methoxyphenyl)methyl-methyl-[2-(2-methyl-5-nitroanilino)-2-oxoethyl]azanium Traditional Name: [2-keto-2-(2-methyl-5-nitro-anilino)ethyl]-m-anisyl-methyl-ammonium Formula: C18H22N3O4+ MolecularWeight: 344.38498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC(=CC=C2)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C18H21N3O4/c1-13-7-8-15(21(23)24)10-17(13)19-18(22)12-20(2)11-14-5-4-6-16(9-14)25-3/h4-10H,11-12H2,1-3H3,(H,19,22)/p+1