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

Systemtic Name: (4-dimethylaminophenyl)methyl-ethyl-[2-[(2-methoxy-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-ethyl-[2-(2-methoxy-4-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-ethyl-[2-(2-methoxy-4-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-ethyl-[2-(2-methoxy-4-nitroanilino)-2-oxoethyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-ethyl-[2-keto-2-(2-methoxy-4-nitro-anilino)ethyl]ammonium Formula: C20H27N4O4+ MolecularWeight: 387.45278

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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-])OC

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O4/c1-5-23(13-15-6-8-16(9-7-15)22(2)3)14-20(25)21-18-11-10-17(24(26)27)12-19(18)28-4/h6-12H,5,13-14H2,1-4H3,(H,21,25)/p+1