N-(2,3-dihydro-1H-inden-5-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-indan-5-yl-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-indan-5-yl-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C25H28N3O3S+ MolecularWeight: 450.57312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H27N3O3S/c29-25(26-23-10-8-20-6-3-7-21(20)16-23)18-27-12-14-28(15-13-27)32(30,31)24-11-9-19-4-1-2-5-22(19)17-24/h1-2,4-5,8-11,16-17H,3,6-7,12-15,18H2,(H,26,29)/p+1