1-[4-[1,3-benzodioxol-5-yl-(4-methoxyphenyl)methyl]piperazin-1-yl]-3,3-diphenyl-propan-1-one

Systemtic Name: 1-[4-[1,3-benzodioxol-5-yl-(4-methoxyphenyl)methyl]piperazin-1-yl]-3,3-diphenyl-propan-1-one Openeye Name: 1-[4-[1,3-benzodioxol-5-yl-(4-methoxyphenyl)methyl]piperazin-1-yl]-3,3-diphenyl-propan-1-one CAS Name: 1-[4-[1,3-benzodioxol-5-yl-(4-methoxyphenyl)methyl]-1-piperazinyl]-3,3-diphenyl-1-propanone IUPAC Name: 1-[4-[1,3-benzodioxol-5-yl-(4-methoxyphenyl)methyl]piperazin-1-yl]-3,3-diphenylpropan-1-one Traditional Name: 1-[4-[1,3-benzodioxol-5-yl-(4-methoxyphenyl)methyl]piperazino]-3,3-diphenyl-propan-1-one Formula: C34H34N2O4 MolecularWeight: 534.64476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC3=C(C=C2)OCO3)N4CCN(CC4)C(=O)CC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC3=C(C=C2)OCO3)N4CCN(CC4)C(=O)CC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H34N2O4/c1-38-29-15-12-27(13-16-29)34(28-14-17-31-32(22-28)40-24-39-31)36-20-18-35(19-21-36)33(37)23-30(25-8-4-2-5-9-25)26-10-6-3-7-11-26/h2-17,22,30,34H,18-21,23-24H2,1H3