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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

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