N-(2-dimethylaminoethyl)-2-nitro-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]benzenesulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-nitro-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]benzenesulfonamide Openeye Name: N-(2-dimethylaminoethyl)-2-nitro-N-[2-[(5-nitro-2-pyridyl)amino]ethyl]benzenesulfonamide CAS Name: N-(2-dimethylaminoethyl)-2-nitro-N-[2-[(5-nitro-2-pyridinyl)amino]ethyl]benzenesulfonamide IUPAC Name: N-(2-dimethylaminoethyl)-2-nitro-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]benzenesulfonamide Traditional Name: N-(2-dimethylaminoethyl)-2-nitro-N-[2-[(5-nitro-2-pyridyl)amino]ethyl]benzenesulfonamide Formula: C17H22N6O6S MolecularWeight: 438.45818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N6O6S/c1-20(2)11-12-21(10-9-18-17-8-7-14(13-19-17)22(24)25)30(28,29)16-6-4-3-5-15(16)23(26)27/h3-8,13H,9-12H2,1-2H3,(H,18,19)