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

Systemtic Name: 2-[3-butyl-4-(2-methoxyphenyl)piperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-[3-butyl-4-(2-methoxyphenyl)piperazin-1-yl]isoindoline-1,3-dione CAS Name: 2-[3-butyl-4-(2-methoxyphenyl)-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-[3-butyl-4-(2-methoxyphenyl)piperazin-1-yl]isoindole-1,3-dione Traditional Name: 2-[3-butyl-4-(2-methoxyphenyl)piperazino]isoindoline-1,3-quinone Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1C2=CC=CC=C2OC)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCCC1CN(CCN1C2=CC=CC=C2OC)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H27N3O3/c1-3-4-9-17-16-24(14-15-25(17)20-12-7-8-13-21(20)29-2)26-22(27)18-10-5-6-11-19(18)23(26)28/h5-8,10-13,17H,3-4,9,14-16H2,1-2H3