5-[6-[3-(1-adamantyl)-4-[2,3-bis(oxidanyl)propoxy]phenyl]naphthalen-2-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[6-[3-(1-adamantyl)-4-[2,3-bis(oxidanyl)propoxy]phenyl]naphthalen-2-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[6-[3-(1-adamantyl)-4-(2,3-dihydroxypropoxy)phenyl]-2-naphthyl]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[6-[3-(1-adamantyl)-4-(2,3-dihydroxypropoxy)phenyl]-2-naphthalenyl]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[6-[3-(1-adamantyl)-4-(2,3-dihydroxypropoxy)phenyl]naphthalen-2-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[6-[3-(1-adamantyl)-4-glyceryloxy-phenyl]-2-naphthyl]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C35H38O7 MolecularWeight: 570.67202

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)C2=CC3=C(C=C2)C=C(C=C3)C4=CC(=C(C=C4)OCC(CO)O)C56CC7CC(C5)CC(C7)C6)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)C2=CC3=C(C=C2)C=C(C=C3)C4=CC(=C(C=C4)OCC(CO)O)C56CC7CC(C5)CC(C7)C6)C

InChI

InChI=1S/C35H38O7/c1-34(2)41-32(38)31(33(39)42-34)27-6-5-23-12-24(3-4-25(23)13-27)26-7-8-30(40-19-28(37)18-36)29(14-26)35-15-20-9-21(16-35)11-22(10-20)17-35/h3-8,12-14,20-22,28,31,36-37H,9-11,15-19H2,1-2H3