3-[2-oxidanylidene-2-(4-prop-2-ynylpiperazin-1-yl)ethyl]-2-phenyl-3,5,6,7-tetrahydrocyclopenta[f]isoindol-1-one

Systemtic Name: 3-[2-oxidanylidene-2-(4-prop-2-ynylpiperazin-1-yl)ethyl]-2-phenyl-3,5,6,7-tetrahydrocyclopenta[f]isoindol-1-one Openeye Name: 3-[2-oxo-2-(4-prop-2-ynylpiperazin-1-yl)ethyl]-2-phenyl-3,5,6,7-tetrahydrocyclopenta[f]isoindol-1-one CAS Name: 3-[2-oxo-2-(4-prop-2-ynyl-1-piperazinyl)ethyl]-2-phenyl-3,5,6,7-tetrahydrocyclopenta[f]isoindol-1-one IUPAC Name: 3-[2-oxo-2-(4-prop-2-ynylpiperazin-1-yl)ethyl]-2-phenyl-3,5,6,7-tetrahydrocyclopenta[f]isoindol-1-one Traditional Name: 3-[2-keto-2-(4-propargylpiperazino)ethyl]-2-phenyl-3,5,6,7-tetrahydrocyclopent[f]isoindol-1-one Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCN(CC1)C(=O)CC2C3=CC4=C(CCC4)C=C3C(=O)N2C5=CC=CC=C5

Isomeric SMILES

C#CCN1CCN(CC1)C(=O)CC2C3=CC4=C(CCC4)C=C3C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C26H27N3O2/c1-2-11-27-12-14-28(15-13-27)25(30)18-24-22-16-19-7-6-8-20(19)17-23(22)26(31)29(24)21-9-4-3-5-10-21/h1,3-5,9-10,16-17,24H,6-8,11-15,18H2