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

Systemtic Name: 2-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[4-(4-methoxyphenyl)-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[4-(4-methoxyphenyl)piperazino]methyl]isoindoline-1,3-quinone Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H21N3O3/c1-26-16-8-6-15(7-9-16)22-12-10-21(11-13-22)14-23-19(24)17-4-2-3-5-18(17)20(23)25/h2-9H,10-14H2,1H3