diethyl-methyl-[2-[[4-[methyl(phenylsulfonyl)amino]-2-nitro-phenyl]amino]ethyl]azanium

Systemtic Name: diethyl-methyl-[2-[[4-[methyl(phenylsulfonyl)amino]-2-nitro-phenyl]amino]ethyl]azanium Openeye Name: 2-[4-[benzenesulfonyl(methyl)amino]-2-nitro-anilino]ethyl-diethyl-methyl-ammonium CAS Name: 2-[4-[benzenesulfonyl(methyl)amino]-2-nitroanilino]ethyl-diethyl-methylammonium IUPAC Name: 2-[4-[benzenesulfonyl(methyl)amino]-2-nitroanilino]ethyl-diethyl-methylazanium Traditional Name: 2-[4-[besyl(methyl)amino]-2-nitro-anilino]ethyl-diethyl-methyl-ammonium Formula: C20H29N4O4S+ MolecularWeight: 421.53366

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCNC1=C(C=C(C=C1)N(C)S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC[N+](C)(CC)CCNC1=C(C=C(C=C1)N(C)S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H29N4O4S/c1-5-24(4,6-2)15-14-21-19-13-12-17(16-20(19)23(25)26)22(3)29(27,28)18-10-8-7-9-11-18/h7-13,16,21H,5-6,14-15H2,1-4H3/q+1