O4-[1-(2-cyclohexyl-2-oxidanylidene-ethyl)piperidin-4-yl] O1-methyl (E)-but-2-enedioate; 2,3-dihydroisoindol-1-one

Systemtic Name: O4-[1-(2-cyclohexyl-2-oxidanylidene-ethyl)piperidin-4-yl] O1-methyl (E)-but-2-enedioate; 2,3-dihydroisoindol-1-one Openeye Name: O4-[1-(2-cyclohexyl-2-oxo-ethyl)-4-piperidyl] O1-methyl (E)-but-2-enedioate; isoindolin-1-one CAS Name: (E)-2-butenedioic acid O4-[1-(2-cyclohexyl-2-oxoethyl)-4-piperidinyl] ester O1-methyl ester; 2,3-dihydroisoindol-1-one IUPAC Name: 4-O-[1-(2-cyclohexyl-2-oxoethyl)piperidin-4-yl] 1-O-methyl (E)-but-2-enedioate; 2,3-dihydroisoindol-1-one Traditional Name: (E)-but-2-enedioic acid O4-[1-(2-cyclohexyl-2-keto-ethyl)-4-piperidyl] ester O1-methyl ester; isoindolin-1-one Formula: C26H34N2O6 MolecularWeight: 470.55796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)OC1CCN(CC1)CC(=O)C2CCCCC2.C1C2=CC=CC=C2C(=O)N1

Isomeric SMILES

COC(=O)/C=C/C(=O)OC1CCN(CC1)CC(=O)C2CCCCC2.C1C2=CC=CC=C2C(=O)N1

InChI

InChI=1S/C18H27NO5.C8H7NO/c1-23-17(21)7-8-18(22)24-15-9-11-19(12-10-15)13-16(20)14-5-3-2-4-6-14;10-8-7-4-2-1-3-6(7)5-9-8/h7-8,14-15H,2-6,9-13H2,1H3;1-4H,5H2,(H,9,10)/b8-7+;