N-ethyl-2-[4-(4-ethylphenyl)sulfonyl-1,4-diazepan-1-ium-1-yl]ethanamide

Systemtic Name: N-ethyl-2-[4-(4-ethylphenyl)sulfonyl-1,4-diazepan-1-ium-1-yl]ethanamide Openeye Name: N-ethyl-2-[4-(4-ethylphenyl)sulfonyl-1,4-diazepan-1-ium-1-yl]acetamide CAS Name: N-ethyl-2-[4-(4-ethylphenyl)sulfonyl-1,4-diazepan-1-ium-1-yl]acetamide IUPAC Name: N-ethyl-2-[4-(4-ethylphenyl)sulfonyl-1,4-diazepan-1-ium-1-yl]acetamide Traditional Name: N-ethyl-2-[4-(4-ethylphenyl)sulfonyl-1,4-diazepan-1-ium-1-yl]acetamide Formula: C17H28N3O3S+ MolecularWeight: 354.48752

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCC[NH+](CC2)CC(=O)NCC

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCC[NH+](CC2)CC(=O)NCC

InChI

InChI=1S/C17H27N3O3S/c1-3-15-6-8-16(9-7-15)24(22,23)20-11-5-10-19(12-13-20)14-17(21)18-4-2/h6-9H,3-5,10-14H2,1-2H3,(H,18,21)/p+1