(2,2-diphenyl-1,3-benzodioxol-5-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2,2-diphenyl-1,3-benzodioxol-5-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: (2,2-diphenyl-1,3-benzodioxol-5-yl)-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: (2,2-diphenyl-1,3-benzodioxol-5-yl)-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: (2,2-diphenyl-1,3-benzodioxol-5-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: (2,2-diphenyl-1,3-benzodioxol-5-yl)-[4-(2-pyridyl)piperazino]methanone Formula: C29H25N3O3 MolecularWeight: 463.5271

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=CC4=C(C=C3)OC(O4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=CC4=C(C=C3)OC(O4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H25N3O3/c33-28(32-19-17-31(18-20-32)27-13-7-8-16-30-27)22-14-15-25-26(21-22)35-29(34-25,23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-16,21H,17-20H2