N-(6-azanylhexyl)-2-nitro-benzenesulfonamide hydrochloride

Systemtic Name: N-(6-azanylhexyl)-2-nitro-benzenesulfonamide hydrochloride Openeye Name: N-(6-aminohexyl)-2-nitro-benzenesulfonamide hydrochloride CAS Name: N-(6-aminohexyl)-2-nitrobenzenesulfonamide hydrochloride IUPAC Name: N-(6-aminohexyl)-2-nitrobenzenesulfonamide hydrochloride Traditional Name: N-(6-aminohexyl)-2-nitro-benzenesulfonamide hydrochloride Formula: C12H20ClN3O4S MolecularWeight: 337.8229

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCCCCCCN.Cl

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCCCCCCN.Cl

InChI

InChI=1S/C12H19N3O4S.ClH/c13-9-5-1-2-6-10-14-20(18,19)12-8-4-3-7-11(12)15(16)17;/h3-4,7-8,14H,1-2,5-6,9-10,13H2;1H