N-ethyl-2-(4-naphthalen-2-ylsulfonyl-1,4-diazepan-1-ium-1-yl)ethanamide

Systemtic Name: N-ethyl-2-(4-naphthalen-2-ylsulfonyl-1,4-diazepan-1-ium-1-yl)ethanamide Openeye Name: N-ethyl-2-[4-(2-naphthylsulfonyl)-1,4-diazepan-1-ium-1-yl]acetamide CAS Name: N-ethyl-2-[4-(2-naphthalenylsulfonyl)-1,4-diazepan-1-ium-1-yl]acetamide IUPAC Name: N-ethyl-2-(4-naphthalen-2-ylsulfonyl-1,4-diazepan-1-ium-1-yl)acetamide Traditional Name: N-ethyl-2-[4-(2-naphthylsulfonyl)-1,4-diazepan-1-ium-1-yl]acetamide Formula: C19H26N3O3S+ MolecularWeight: 376.49304

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C[NH+]1CCCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCNC(=O)C[NH+]1CCCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H25N3O3S/c1-2-20-19(23)15-21-10-5-11-22(13-12-21)26(24,25)18-9-8-16-6-3-4-7-17(16)14-18/h3-4,6-9,14H,2,5,10-13,15H2,1H3,(H,20,23)/p+1