2-(azepan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C16H26N3O3S+ MolecularWeight: 340.46094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C1CCC[NH+](CC1)CC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H25N3O3S/c17-23(21,22)15-7-5-14(6-8-15)9-10-18-16(20)13-19-11-3-1-2-4-12-19/h5-8H,1-4,9-13H2,(H,18,20)(H2,17,21,22)/p+1