2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-piperidyl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinyl]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidino]-1-(4-phenylpiperazino)ethanone Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)CC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)CC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H31N3O4/c30-25(29-14-12-28(13-15-29)22-4-2-1-3-5-22)19-27-10-8-20(9-11-27)26(31)21-6-7-23-24(18-21)33-17-16-32-23/h1-7,18,20H,8-17,19H2