2-[4-(azepan-1-ylsulfonyl)piperazin-1-ium-1-yl]-N-[(1R)-1-naphthalen-1-ylethyl]ethanamide

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-ium-1-yl]-N-[(1R)-1-naphthalen-1-ylethyl]ethanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(1-naphthyl)ethyl]acetamide CAS Name: 2-[4-(1-azepanylsulfonyl)-1-piperazin-1-iumyl]-N-[(1R)-1-(1-naphthalenyl)ethyl]acetamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-ium-1-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(1-naphthyl)ethyl]acetamide Formula: C24H35N4O3S+ MolecularWeight: 459.6247

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

C[C@H](C1=CC=CC2=CC=CC=C21)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H34N4O3S/c1-20(22-12-8-10-21-9-4-5-11-23(21)22)25-24(29)19-26-15-17-28(18-16-26)32(30,31)27-13-6-2-3-7-14-27/h4-5,8-12,20H,2-3,6-7,13-19H2,1H3,(H,25,29)/p+1/t20-/m1/s1