4-[4-(2-methylpropyl)piperazin-1-yl]-2-[[(2R)-oxolan-2-yl]methyl]isoindole-1,3-dione

Systemtic Name: 4-[4-(2-methylpropyl)piperazin-1-yl]-2-[[(2R)-oxolan-2-yl]methyl]isoindole-1,3-dione Openeye Name: 4-(4-isobutylpiperazin-1-yl)-2-[[(2R)-tetrahydrofuran-2-yl]methyl]isoindoline-1,3-dione CAS Name: 4-[4-(2-methylpropyl)-1-piperazinyl]-2-[[(2R)-2-oxolanyl]methyl]isoindole-1,3-dione IUPAC Name: 4-[4-(2-methylpropyl)piperazin-1-yl]-2-[[(2R)-oxolan-2-yl]methyl]isoindole-1,3-dione Traditional Name: 4-(4-isobutylpiperazino)-2-[[(2R)-tetrahydrofuran-2-yl]methyl]isoindoline-1,3-quinone Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)CC4CCCO4

Isomeric SMILES

CC(C)CN1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)C[C@H]4CCCO4

InChI

InChI=1S/C21H29N3O3/c1-15(2)13-22-8-10-23(11-9-22)18-7-3-6-17-19(18)21(26)24(20(17)25)14-16-5-4-12-27-16/h3,6-7,15-16H,4-5,8-14H2,1-2H3/t16-/m1/s1