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

Systemtic Name: O4-[1-(2-cyclohexyl-2-oxidanyl-ethyl)piperidin-4-yl] O1-methyl (E)-but-2-enedioate; 2,3-dihydroisoindol-1-one Openeye Name: O4-[1-(2-cyclohexyl-2-hydroxy-ethyl)-4-piperidyl] O1-methyl (E)-but-2-enedioate; isoindolin-1-one CAS Name: (E)-2-butenedioic acid O4-[1-(2-cyclohexyl-2-hydroxyethyl)-4-piperidinyl] ester O1-methyl ester; 2,3-dihydroisoindol-1-one IUPAC Name: 4-O-[1-(2-cyclohexyl-2-hydroxyethyl)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-hydroxy-ethyl)-4-piperidyl] ester O1-methyl ester; isoindolin-1-one Formula: C26H36N2O6 MolecularWeight: 472.57384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29NO5.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/h7-8,14-16,20H,2-6,9-13H2,1H3;1-4H,5H2,(H,9,10)/b8-7+;