N-tert-butyl-2-[4-[2-[methyl(naphthalen-2-ylsulfonyl)amino]ethanoyl]-1,4-diazepan-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[methyl(naphthalen-2-ylsulfonyl)amino]ethanoyl]-1,4-diazepan-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[methyl(2-naphthylsulfonyl)amino]acetyl]-1,4-diazepan-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-[methyl(2-naphthalenylsulfonyl)amino]-1-oxoethyl]-1,4-diazepan-1-ium-1-yl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-[methyl(naphthalen-2-ylsulfonyl)amino]acetyl]-1,4-diazepan-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-[methyl(2-naphthylsulfonyl)amino]acetyl]-1,4-diazepan-1-ium-1-yl]acetamide Formula: C24H35N4O4S+ MolecularWeight: 475.6241

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34N4O4S/c1-24(2,3)25-22(29)17-27-12-7-13-28(15-14-27)23(30)18-26(4)33(31,32)21-11-10-19-8-5-6-9-20(19)16-21/h5-6,8-11,16H,7,12-15,17-18H2,1-4H3,(H,25,29)/p+1