methyl 2-nitro-6-(2-piperidin-1-ylethylsulfamoyl)benzoate hydrochloride

Systemtic Name: methyl 2-nitro-6-(2-piperidin-1-ylethylsulfamoyl)benzoate hydrochloride Openeye Name: methyl 2-nitro-6-[2-(1-piperidyl)ethylsulfamoyl]benzoate hydrochloride CAS Name: 2-nitro-6-[2-(1-piperidinyl)ethylsulfamoyl]benzoic acid methyl ester hydrochloride IUPAC Name: methyl 2-nitro-6-(2-piperidin-1-ylethylsulfamoyl)benzoate hydrochloride Traditional Name: 2-nitro-6-(2-piperidinoethylsulfamoyl)benzoic acid methyl ester hydrochloride Formula: C15H22ClN3O6S MolecularWeight: 407.86968

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1S(=O)(=O)NCCN2CCCCC2)[N+](=O)[O-].Cl

Isomeric SMILES

COC(=O)C1=C(C=CC=C1S(=O)(=O)NCCN2CCCCC2)[N+](=O)[O-].Cl

InChI

InChI=1S/C15H21N3O6S.ClH/c1-24-15(19)14-12(18(20)21)6-5-7-13(14)25(22,23)16-8-11-17-9-3-2-4-10-17;/h5-7,16H,2-4,8-11H2,1H3;1H