3-[4-[2-(dimethylamino)-1-(1-oxidanylcyclohexyl)ethyl]phenoxy]-3H-2-benzofuran-1-one

Systemtic Name: 3-[4-[2-(dimethylamino)-1-(1-oxidanylcyclohexyl)ethyl]phenoxy]-3H-2-benzofuran-1-one Openeye Name: 3-[4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenoxy]-3H-isobenzofuran-1-one CAS Name: 3-[4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenoxy]-3H-isobenzofuran-1-one IUPAC Name: 3-[4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenoxy]-3H-2-benzofuran-1-one Traditional Name: 3-[4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenoxy]phthalide Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(C1=CC=C(C=C1)OC2C3=CC=CC=C3C(=O)O2)C4(CCCCC4)O

Isomeric SMILES

CN(C)CC(C1=CC=C(C=C1)OC2C3=CC=CC=C3C(=O)O2)C4(CCCCC4)O

InChI

InChI=1S/C24H29NO4/c1-25(2)16-21(24(27)14-6-3-7-15-24)17-10-12-18(13-11-17)28-23-20-9-5-4-8-19(20)22(26)29-23/h4-5,8-13,21,23,27H,3,6-7,14-16H2,1-2H3