1-[4-[(2R)-3-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[(2R)-3-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[(2R)-3-(4-benzhydrylpiperazin-1-yl)-2-hydroxy-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[(2R)-3-[4-(diphenylmethyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[(2R)-3-(4-benzhydrylpiperazin-1-yl)-2-hydroxypropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[(2R)-3-(4-benzhydrylpiperazino)-2-hydroxy-propoxy]phenyl]propan-1-one Formula: C29H34N2O3 MolecularWeight: 458.59186

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC[C@@H](CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C29H34N2O3/c1-2-28(33)23-13-15-27(16-14-23)34-22-26(32)21-30-17-19-31(20-18-30)29(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,26,29,32H,2,17-22H2,1H3/t26-/m1/s1