(2R)-1-(2,3-dihydro-1H-inden-5-yloxy)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2R)-1-(2,3-dihydro-1H-inden-5-yloxy)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-indan-5-yloxy-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(2,3-dihydro-1H-inden-5-yloxy)-3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(2,3-dihydro-1H-inden-5-yloxy)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-indan-5-yloxy-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CC(COC3=CC4=C(CCC4)C=C3)O

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)C[C@H](COC3=CC4=C(CCC4)C=C3)O

InChI

InChI=1S/C23H30N2O3/c1-27-23-8-3-2-7-22(23)25-13-11-24(12-14-25)16-20(26)17-28-21-10-9-18-5-4-6-19(18)15-21/h2-3,7-10,15,20,26H,4-6,11-14,16-17H2,1H3/p+1/t20-/m1/s1