5,6-dimethyl-3-[2-oxidanylidene-2-(4-prop-2-enylpiperazin-1-yl)ethyl]-2-phenyl-3H-isoindol-1-one

Systemtic Name: 5,6-dimethyl-3-[2-oxidanylidene-2-(4-prop-2-enylpiperazin-1-yl)ethyl]-2-phenyl-3H-isoindol-1-one Openeye Name: 3-[2-(4-allylpiperazin-1-yl)-2-oxo-ethyl]-5,6-dimethyl-2-phenyl-isoindolin-1-one CAS Name: 5,6-dimethyl-3-[2-oxo-2-(4-prop-2-enyl-1-piperazinyl)ethyl]-2-phenyl-3H-isoindol-1-one IUPAC Name: 5,6-dimethyl-3-[2-oxo-2-(4-prop-2-enylpiperazin-1-yl)ethyl]-2-phenyl-3H-isoindol-1-one Traditional Name: 3-[2-(4-allylpiperazino)-2-keto-ethyl]-5,6-dimethyl-2-phenyl-isoindolin-1-one Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(N(C2=O)C3=CC=CC=C3)CC(=O)N4CCN(CC4)CC=C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(N(C2=O)C3=CC=CC=C3)CC(=O)N4CCN(CC4)CC=C)C

InChI

InChI=1S/C25H29N3O2/c1-4-10-26-11-13-27(14-12-26)24(29)17-23-21-15-18(2)19(3)16-22(21)25(30)28(23)20-8-6-5-7-9-20/h4-9,15-16,23H,1,10-14,17H2,2-3H3