[2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]carbonyl-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]carbonyl-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]indan-2-yl]-methyl-ammonium CAS Name: [2-[[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-oxomethyl]-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]-1,3-dihydroinden-2-yl]-methylazanium Traditional Name: benzyl-[2-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]indan-2-yl]-methyl-ammonium Formula: C24H33N3O2+2 MolecularWeight: 395.53772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)C(=O)N4CC[NH+](CC4)CCO

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)C(=O)N4CC[NH+](CC4)CCO

InChI

InChI=1S/C24H31N3O2/c1-25(19-20-7-3-2-4-8-20)24(17-21-9-5-6-10-22(21)18-24)23(29)27-13-11-26(12-14-27)15-16-28/h2-10,28H,11-19H2,1H3/p+2