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

Systemtic Name: 3-methylidene-2-[2-oxidanylidene-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl]isoindol-1-one Openeye Name: 3-methylene-2-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl]isoindolin-1-one CAS Name: 3-methylene-2-[2-oxo-2-[4-(2-phenoxyethyl)-1-piperazinyl]ethyl]-1-isoindolone IUPAC Name: 3-methylidene-2-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethyl]isoindol-1-one Traditional Name: 2-[2-keto-2-[4-(2-phenoxyethyl)piperazino]ethyl]-3-methylene-isoindolin-1-one Formula: C23H25N3O3 MolecularWeight: 391.4629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CC(=O)N3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CC(=O)N3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c1-18-20-9-5-6-10-21(20)23(28)26(18)17-22(27)25-13-11-24(12-14-25)15-16-29-19-7-3-2-4-8-19/h2-10H,1,11-17H2