3-(3,5-dimethoxyphenyl)-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethoxyphenyl)-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(3,5-dimethoxyphenyl)propan-1-one CAS Name: 3-(3,5-dimethoxyphenyl)-1-[4-(diphenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(3,5-dimethoxyphenyl)propan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-3-(3,5-dimethoxyphenyl)propan-1-one Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C28H32N2O3/c1-32-25-19-22(20-26(21-25)33-2)13-14-27(31)29-15-17-30(18-16-29)28(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-12,19-21,28H,13-18H2,1-2H3