5-[4-(2-cyclopentylethanoyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)isoindole-1,3-dione

Systemtic Name: 5-[4-(2-cyclopentylethanoyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)isoindole-1,3-dione Openeye Name: 2-benzyl-5-[4-(2-cyclopentylacetyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 5-[[4-(2-cyclopentyl-1-oxoethyl)-1-piperazinyl]-oxomethyl]-2-(phenylmethyl)isoindole-1,3-dione IUPAC Name: 2-benzyl-5-[4-(2-cyclopentylacetyl)piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-benzyl-5-[4-(2-cyclopentylacetyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)CC(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

InChI

InChI=1S/C27H29N3O4/c31-24(16-19-6-4-5-7-19)28-12-14-29(15-13-28)25(32)21-10-11-22-23(17-21)27(34)30(26(22)33)18-20-8-2-1-3-9-20/h1-3,8-11,17,19H,4-7,12-16,18H2