sulfamoyl 2-[4-(1,4-diazepan-1-yl)phenyl]ethanoate dihydrochloride

Systemtic Name: sulfamoyl 2-[4-(1,4-diazepan-1-yl)phenyl]ethanoate dihydrochloride Openeye Name: sulfamoyl 2-[4-(1,4-diazepan-1-yl)phenyl]acetate dihydrochloride CAS Name: 2-[4-(1,4-diazepan-1-yl)phenyl]acetic acid sulfamoyl ester dihydrochloride IUPAC Name: sulfamoyl 2-[4-(1,4-diazepan-1-yl)phenyl]acetate dihydrochloride Traditional Name: 2-[4-(1,4-diazepan-1-yl)phenyl]acetic acid sulfamoyl ester dihydrochloride Formula: C13H21Cl2N3O4S MolecularWeight: 386.29454

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC=C(C=C2)CC(=O)OS(=O)(=O)N.Cl.Cl

Isomeric SMILES

C1CNCCN(C1)C2=CC=C(C=C2)CC(=O)OS(=O)(=O)N.Cl.Cl

InChI

InChI=1S/C13H19N3O4S.2ClH/c14-21(18,19)20-13(17)10-11-2-4-12(5-3-11)16-8-1-6-15-7-9-16;;/h2-5,15H,1,6-10H2,(H2,14,18,19);2*1H