2-(azepan-1-ium-1-yl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-[4-[isopropyl(methyl)sulfamoyl]phenyl]acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-[4-[isopropyl(methyl)sulfamoyl]phenyl]acetamide Formula: C18H30N3O3S+ MolecularWeight: 368.5141

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C[NH+]2CCCCCC2

Isomeric SMILES

CC(C)N(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C[NH+]2CCCCCC2

InChI

InChI=1S/C18H29N3O3S/c1-15(2)20(3)25(23,24)17-10-8-16(9-11-17)19-18(22)14-21-12-6-4-5-7-13-21/h8-11,15H,4-7,12-14H2,1-3H3,(H,19,22)/p+1