cyclopropyl-[(4-methoxyphenyl)methyl]-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-(2-methyl-5-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-(2-methyl-5-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-(2-methyl-5-nitroanilino)-2-oxoethyl]azanium Traditional Name: cyclopropyl-[2-keto-2-(2-methyl-5-nitro-anilino)ethyl]-p-anisyl-ammonium Formula: C20H24N3O4+ MolecularWeight: 370.42226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C[NH+](CC2=CC=C(C=C2)OC)C3CC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C[NH+](CC2=CC=C(C=C2)OC)C3CC3

InChI

InChI=1S/C20H23N3O4/c1-14-3-6-17(23(25)26)11-19(14)21-20(24)13-22(16-7-8-16)12-15-4-9-18(27-2)10-5-15/h3-6,9-11,16H,7-8,12-13H2,1-2H3,(H,21,24)/p+1