N-ethyl-2-[4-[4-(propan-2-ylsulfamoyl)phenyl]carbonyl-1,4-diazepan-1-ium-1-yl]ethanamide

Systemtic Name: N-ethyl-2-[4-[4-(propan-2-ylsulfamoyl)phenyl]carbonyl-1,4-diazepan-1-ium-1-yl]ethanamide Openeye Name: N-ethyl-2-[4-[4-(isopropylsulfamoyl)benzoyl]-1,4-diazepan-1-ium-1-yl]acetamide CAS Name: N-ethyl-2-[4-[oxo-[4-(propan-2-ylsulfamoyl)phenyl]methyl]-1,4-diazepan-1-ium-1-yl]acetamide IUPAC Name: N-ethyl-2-[4-[4-(propan-2-ylsulfamoyl)benzoyl]-1,4-diazepan-1-ium-1-yl]acetamide Traditional Name: N-ethyl-2-[4-[4-(isopropylsulfamoyl)benzoyl]-1,4-diazepan-1-ium-1-yl]acetamide Formula: C19H31N4O4S+ MolecularWeight: 411.53884

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C[NH+]1CCCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC(C)C

Isomeric SMILES

CCNC(=O)C[NH+]1CCCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC(C)C

InChI

InChI=1S/C19H30N4O4S/c1-4-20-18(24)14-22-10-5-11-23(13-12-22)19(25)16-6-8-17(9-7-16)28(26,27)21-15(2)3/h6-9,15,21H,4-5,10-14H2,1-3H3,(H,20,24)/p+1