6-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]-2,3-dihydro-1H-inden-5-ol

Systemtic Name: 6-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]-2,3-dihydro-1H-inden-5-ol Openeye Name: 6-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]indan-5-ol CAS Name: 6-[[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]methyl]-2,3-dihydro-1H-inden-5-ol IUPAC Name: 6-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]-2,3-dihydro-1H-inden-5-ol Traditional Name: 6-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]indan-5-ol Formula: C22H30N2O2+2 MolecularWeight: 354.4858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC(=C(C=C2C1)O)C[NH+]3CC[NH+](CC3)CCOC4=CC=CC=C4

Isomeric SMILES

C1CC2=CC(=C(C=C2C1)O)C[NH+]3CC[NH+](CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C22H28N2O2/c25-22-16-19-6-4-5-18(19)15-20(22)17-24-11-9-23(10-12-24)13-14-26-21-7-2-1-3-8-21/h1-3,7-8,15-16,25H,4-6,9-14,17H2/p+2