2-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]propyl]isoindoline-1,3-quinone Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C(=O)C3=CC=CC=C3C2=O)CC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCN1CCCN2C(=O)C3=CC=CC=C3C2=O)CC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C24H27N3O4/c28-23-19-4-1-2-5-20(19)24(29)27(23)9-3-8-25-10-12-26(13-11-25)17-18-6-7-21-22(16-18)31-15-14-30-21/h1-2,4-7,16H,3,8-15,17H2