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

Systemtic Name: 2-(4-ethoxyphenyl)-5-[4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 2-(4-ethoxyphenyl)-5-[4-(2-methylpropanoyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-(4-ethoxyphenyl)-5-[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]isoindole-1,3-dione IUPAC Name: 2-(4-ethoxyphenyl)-5-[4-(2-methylpropanoyl)piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 5-(4-isobutyrylpiperazine-1-carbonyl)-2-p-phenetyl-isoindoline-1,3-quinone Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C(=O)C(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C(=O)C(C)C

InChI

InChI=1S/C25H27N3O5/c1-4-33-19-8-6-18(7-9-19)28-24(31)20-10-5-17(15-21(20)25(28)32)23(30)27-13-11-26(12-14-27)22(29)16(2)3/h5-10,15-16H,4,11-14H2,1-3H3