3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]-2-methyl-3-piperidin-4-yl-isoindol-1-one

Systemtic Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]-2-methyl-3-piperidin-4-yl-isoindol-1-one Openeye Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-ethyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one CAS Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-2-methyl-3-(4-piperidinyl)-1-isoindolone IUPAC Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-2-methyl-3-piperidin-4-ylisoindol-1-one Traditional Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-keto-ethyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one Formula: C24H26N2O4 MolecularWeight: 406.47424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C1(CC(=O)C3=CC4=C(C=C3)OCCO4)C5CCNCC5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C1(CC(=O)C3=CC4=C(C=C3)OCCO4)C5CCNCC5

InChI

InChI=1S/C24H26N2O4/c1-26-23(28)18-4-2-3-5-19(18)24(26,17-8-10-25-11-9-17)15-20(27)16-6-7-21-22(14-16)30-13-12-29-21/h2-7,14,17,25H,8-13,15H2,1H3