1-(1,3-benzodioxol-5-yloxy)-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol

Systemtic Name: 1-(1,3-benzodioxol-5-yloxy)-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(1,3-benzodioxol-5-yloxy)propan-2-ol CAS Name: 1-(1,3-benzodioxol-5-yloxy)-3-[4-(diphenylmethyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(1,3-benzodioxol-5-yloxy)propan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-(1,3-benzodioxol-5-yloxy)propan-2-ol Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC3=C(C=C2)OCO3)O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC(COC2=CC3=C(C=C2)OCO3)O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H30N2O4/c30-23(19-31-24-11-12-25-26(17-24)33-20-32-25)18-28-13-15-29(16-14-28)27(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-12,17,23,27,30H,13-16,18-20H2