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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-[4-[2-(diphenylmethyl)oxyethyl]piperazin-1-yl]-1-piperazin-1-yl-propan-1-one Openeye Name: 2-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-3-(1,3-benzodioxol-5-yl)-1-piperazin-1-yl-propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-2-[4-[2-(diphenylmethyl)oxyethyl]-1-piperazinyl]-1-(1-piperazinyl)-1-propanone IUPAC Name: 2-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-3-(1,3-benzodioxol-5-yl)-1-piperazin-1-ylpropan-1-one Traditional Name: 2-[4-(2-benzhydryloxyethyl)piperazino]-3-(1,3-benzodioxol-5-yl)-1-piperazino-propan-1-one Formula: C33H40N4O4 MolecularWeight: 556.6951

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C(CC2=CC3=C(C=C2)OCO3)N4CCN(CC4)CCOC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1)C(=O)C(CC2=CC3=C(C=C2)OCO3)N4CCN(CC4)CCOC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H40N4O4/c38-33(37-15-13-34-14-16-37)29(23-26-11-12-30-31(24-26)41-25-40-30)36-19-17-35(18-20-36)21-22-39-32(27-7-3-1-4-8-27)28-9-5-2-6-10-28/h1-12,24,29,32,34H,13-23,25H2