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

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-isoquinolin-5-yloxy-propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(5-isoquinolyloxy)propan-2-ol CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-(5-isoquinolinyloxy)-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-isoquinolin-5-yloxypropan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-(5-isoquinolyloxy)propan-2-ol Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=CC3=C2C=CN=C3)O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=CC3=C2C=CN=C3)O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N3O2/c33-26(22-34-28-13-7-12-25-20-30-15-14-27(25)28)21-31-16-18-32(19-17-31)29(23-8-3-1-4-9-23)24-10-5-2-6-11-24/h1-15,20,26,29,33H,16-19,21-22H2