2-(2-dimethylaminoethylsulfamoyl)-N-(2-hydroxyethyl)-4-nitro-benzamide hydrochloride

Systemtic Name: 2-(2-dimethylaminoethylsulfamoyl)-N-(2-hydroxyethyl)-4-nitro-benzamide hydrochloride Openeye Name: 2-(2-dimethylaminoethylsulfamoyl)-N-(2-hydroxyethyl)-4-nitro-benzamide hydrochloride CAS Name: 2-(2-dimethylaminoethylsulfamoyl)-N-(2-hydroxyethyl)-4-nitrobenzamide hydrochloride IUPAC Name: 2-(2-dimethylaminoethylsulfamoyl)-N-(2-hydroxyethyl)-4-nitrobenzamide hydrochloride Traditional Name: 2-(2-dimethylaminoethylsulfamoyl)-N-(2-hydroxyethyl)-4-nitro-benzamide hydrochloride Formula: C13H21ClN4O6S MolecularWeight: 396.84704

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)NCCO.Cl

Isomeric SMILES

CN(C)CCNS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)NCCO.Cl

InChI

InChI=1S/C13H20N4O6S.ClH/c1-16(2)7-5-15-24(22,23)12-9-10(17(20)21)3-4-11(12)13(19)14-6-8-18;/h3-4,9,15,18H,5-8H2,1-2H3,(H,14,19);1H