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

Systemtic Name: 5,6-dimethyl-3-[2-oxidanylidene-2-(4-propylpiperazin-1-yl)ethyl]-2-phenyl-3H-isoindol-1-one Openeye Name: 5,6-dimethyl-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2-phenyl-isoindolin-1-one CAS Name: 5,6-dimethyl-3-[2-oxo-2-(4-propyl-1-piperazinyl)ethyl]-2-phenyl-3H-isoindol-1-one IUPAC Name: 5,6-dimethyl-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2-phenyl-3H-isoindol-1-one Traditional Name: 3-[2-keto-2-(4-propylpiperazino)ethyl]-5,6-dimethyl-2-phenyl-isoindolin-1-one Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)CC2C3=CC(=C(C=C3C(=O)N2C4=CC=CC=C4)C)C

Isomeric SMILES

CCCN1CCN(CC1)C(=O)CC2C3=CC(=C(C=C3C(=O)N2C4=CC=CC=C4)C)C

InChI

InChI=1S/C25H31N3O2/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/h5-9,15-16,23H,4,10-14,17H2,1-3H3