dimethyl-[[4-[[(4-methyl-3-nitro-phenyl)sulfonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[(4-methyl-3-nitro-phenyl)sulfonylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[[(4-methyl-3-nitro-phenyl)sulfonylamino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[[(4-methyl-3-nitrophenyl)sulfonylamino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[[(4-methyl-3-nitrophenyl)sulfonylamino]methyl]phenyl]methyl]azanium Traditional Name: dimethyl-[4-[[(4-methyl-3-nitro-phenyl)sulfonylamino]methyl]benzyl]ammonium Formula: C17H22N3O4S+ MolecularWeight: 364.43928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C[NH+](C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C[NH+](C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O4S/c1-13-4-9-16(10-17(13)20(21)22)25(23,24)18-11-14-5-7-15(8-6-14)12-19(2)3/h4-10,18H,11-12H2,1-3H3/p+1