[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: [2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: [2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl] 2-hydroxy-2,2-diphenyl-acetate CAS Name: 2-hydroxy-2,2-diphenylacetic acid [2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl] 2-hydroxy-2,2-diphenylacetate Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid [2-keto-2-(4-piperonylpiperazino)ethyl] ester Formula: C28H28N2O6 MolecularWeight: 488.53172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)COC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)COC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

InChI

InChI=1S/C28H28N2O6/c31-26(30-15-13-29(14-16-30)18-21-11-12-24-25(17-21)36-20-35-24)19-34-27(32)28(33,22-7-3-1-4-8-22)23-9-5-2-6-10-23/h1-12,17,33H,13-16,18-20H2