3-methylidene-2-[2-oxidanylidene-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethyl]isoindol-1-one

Systemtic Name: 3-methylidene-2-[2-oxidanylidene-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethyl]isoindol-1-one Openeye Name: 3-methylene-2-[2-oxo-2-[4-(8-quinolylmethyl)piperazin-1-yl]ethyl]isoindolin-1-one CAS Name: 3-methylene-2-[2-oxo-2-[4-(8-quinolinylmethyl)-1-piperazinyl]ethyl]-1-isoindolone IUPAC Name: 3-methylidene-2-[2-oxo-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethyl]isoindol-1-one Traditional Name: 2-[2-keto-2-[4-(8-quinolylmethyl)piperazino]ethyl]-3-methylene-isoindolin-1-one Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CC(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CC(=O)N3CCN(CC3)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C25H24N4O2/c1-18-21-9-2-3-10-22(21)25(31)29(18)17-23(30)28-14-12-27(13-15-28)16-20-7-4-6-19-8-5-11-26-24(19)20/h2-11H,1,12-17H2