2-[1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-benzyl-2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[1-[4-(4-methoxyphenyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-benzyl-2-keto-2-[4-(4-methoxyphenyl)piperazino]ethyl]isoindoline-1,3-quinone Formula: C28H27N3O4 MolecularWeight: 469.53168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C28H27N3O4/c1-35-22-13-11-21(12-14-22)29-15-17-30(18-16-29)28(34)25(19-20-7-3-2-4-8-20)31-26(32)23-9-5-6-10-24(23)27(31)33/h2-14,25H,15-19H2,1H3