(4-dimethylaminophenyl)methyl-ethyl-[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-ethyl-[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-ethyl-[2-(2-methyl-4-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-ethyl-[2-(2-methyl-4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-ethyl-[2-(2-methyl-4-nitroanilino)-2-oxoethyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-ethyl-[2-keto-2-(2-methyl-4-nitro-anilino)ethyl]ammonium Formula: C20H27N4O3+ MolecularWeight: 371.45338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O3/c1-5-23(13-16-6-8-17(9-7-16)22(3)4)14-20(25)21-19-11-10-18(24(26)27)12-15(19)2/h6-12H,5,13-14H2,1-4H3,(H,21,25)/p+1