2-[[4-(2-methoxyphenoxy)-3-nitro-phenyl]sulfonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-(2-methoxyphenoxy)-3-nitro-phenyl]sulfonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-(2-methoxyphenoxy)-3-nitro-phenyl]sulfonylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[4-(2-methoxyphenoxy)-3-nitrophenyl]sulfonylamino]ethyl-dimethylammonium IUPAC Name: 2-[[4-(2-methoxyphenoxy)-3-nitrophenyl]sulfonylamino]ethyl-dimethylazanium Traditional Name: 2-[[4-(2-methoxyphenoxy)-3-nitro-phenyl]sulfonylamino]ethyl-dimethyl-ammonium Formula: C17H22N3O6S+ MolecularWeight: 396.43808

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC=C2OC)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CCNS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC=C2OC)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6S/c1-19(2)11-10-18-27(23,24)13-8-9-15(14(12-13)20(21)22)26-17-7-5-4-6-16(17)25-3/h4-9,12,18H,10-11H2,1-3H3/p+1