7-[5-(1,3-dihydroisoindol-2-yl)-2,2-dimethyl-6-propan-2-yl-3H-1-benzofuran-7-yl]-3,5-bis(oxidanyl)heptanoate

Systemtic Name: 7-[5-(1,3-dihydroisoindol-2-yl)-2,2-dimethyl-6-propan-2-yl-3H-1-benzofuran-7-yl]-3,5-bis(oxidanyl)heptanoate Openeye Name: 3,5-dihydroxy-7-(5-isoindolin-2-yl-6-isopropyl-2,2-dimethyl-3H-benzofuran-7-yl)heptanoate CAS Name: 7-[5-(1,3-dihydroisoindol-2-yl)-2,2-dimethyl-6-propan-2-yl-3H-benzofuran-7-yl]-3,5-dihydroxyheptanoate IUPAC Name: 7-[5-(1,3-dihydroisoindol-2-yl)-2,2-dimethyl-6-propan-2-yl-3H-1-benzofuran-7-yl]-3,5-dihydroxyheptanoate Traditional Name: 3,5-dihydroxy-7-(5-isoindolin-2-yl-6-isopropyl-2,2-dimethyl-coumaran-7-yl)enanthate Formula: C28H36NO5- MolecularWeight: 466.58914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C2CC(OC2=C1CCC(CC(CC(=O)[O-])O)O)(C)C)N3CC4=CC=CC=C4C3

Isomeric SMILES

CC(C)C1=C(C=C2CC(OC2=C1CCC(CC(CC(=O)[O-])O)O)(C)C)N3CC4=CC=CC=C4C3

InChI

InChI=1S/C28H37NO5/c1-17(2)26-23(10-9-21(30)12-22(31)13-25(32)33)27-20(14-28(3,4)34-27)11-24(26)29-15-18-7-5-6-8-19(18)16-29/h5-8,11,17,21-22,30-31H,9-10,12-16H2,1-4H3,(H,32,33)/p-1