2-(oxolan-2-ylmethyl)-4-[4-[(2-prop-2-enoxyphenyl)methyl]piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-(oxolan-2-ylmethyl)-4-[4-[(2-prop-2-enoxyphenyl)methyl]piperazin-1-yl]isoindole-1,3-dione Openeye Name: 4-[4-[(2-allyloxyphenyl)methyl]piperazin-1-yl]-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 2-(2-oxolanylmethyl)-4-[4-[(2-prop-2-enoxyphenyl)methyl]-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-(oxolan-2-ylmethyl)-4-[4-[(2-prop-2-enoxyphenyl)methyl]piperazin-1-yl]isoindole-1,3-dione Traditional Name: 4-[4-(2-allyloxybenzyl)piperazino]-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1CN2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5CCCO5

Isomeric SMILES

C=CCOC1=CC=CC=C1CN2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5CCCO5

InChI

InChI=1S/C27H31N3O4/c1-2-16-34-24-11-4-3-7-20(24)18-28-12-14-29(15-13-28)23-10-5-9-22-25(23)27(32)30(26(22)31)19-21-8-6-17-33-21/h2-5,7,9-11,21H,1,6,8,12-19H2