2-[3-oxidanyl-4-[4-(2-propoxyphenyl)piperazin-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[3-oxidanyl-4-[4-(2-propoxyphenyl)piperazin-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[3-hydroxy-4-[4-(2-propoxyphenyl)piperazin-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[3-hydroxy-4-[4-(2-propoxyphenyl)-1-piperazinyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[3-hydroxy-4-[4-(2-propoxyphenyl)piperazin-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[3-hydroxy-4-[4-(2-propoxyphenyl)piperazino]butyl]isoindoline-1,3-quinone Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1N2CCN(CC2)CC(CCN3C(=O)C4=CC=CC=C4C3=O)O

Isomeric SMILES

CCCOC1=CC=CC=C1N2CCN(CC2)CC(CCN3C(=O)C4=CC=CC=C4C3=O)O

InChI

InChI=1S/C25H31N3O4/c1-2-17-32-23-10-6-5-9-22(23)27-15-13-26(14-16-27)18-19(29)11-12-28-24(30)20-7-3-4-8-21(20)25(28)31/h3-10,19,29H,2,11-18H2,1H3