[8-cyano-2-[8-cyano-1-(2,2-dimethylpropanoyloxy)-3-methyl-6,7-bis(oxidanyl)-5-propan-2-yl-naphthalen-2-yl]-3-methyl-6,7-bis(oxidanyl)-5-propan-2-yl-naphthalen-1-yl] 2,2-dimethylpropanoate

Systemtic Name: [8-cyano-2-[8-cyano-1-(2,2-dimethylpropanoyloxy)-3-methyl-6,7-bis(oxidanyl)-5-propan-2-yl-naphthalen-2-yl]-3-methyl-6,7-bis(oxidanyl)-5-propan-2-yl-naphthalen-1-yl] 2,2-dimethylpropanoate Openeye Name: [8-cyano-2-[8-cyano-1-(2,2-dimethylpropanoyloxy)-6,7-dihydroxy-5-isopropyl-3-methyl-2-naphthyl]-6,7-dihydroxy-5-isopropyl-3-methyl-1-naphthyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [8-cyano-2-[8-cyano-1-(2,2-dimethyl-1-oxopropoxy)-6,7-dihydroxy-3-methyl-5-propan-2-yl-2-naphthalenyl]-6,7-dihydroxy-3-methyl-5-propan-2-yl-1-naphthalenyl] ester IUPAC Name: [8-cyano-2-[8-cyano-1-(2,2-dimethylpropanoyloxy)-6,7-dihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl]-6,7-dihydroxy-3-methyl-5-propan-2-ylnaphthalen-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [8-cyano-2-(8-cyano-6,7-dihydroxy-5-isopropyl-3-methyl-1-pivaloyloxy-2-naphthyl)-6,7-dihydroxy-5-isopropyl-3-methyl-1-naphthyl] ester Formula: C40H44N2O8 MolecularWeight: 680.78596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1)C(=C(C(=C2C#N)O)O)C(C)C)OC(=O)C(C)(C)C)C3=C(C=C4C(=C3OC(=O)C(C)(C)C)C(=C(C(=C4C(C)C)O)O)C#N)C

Isomeric SMILES

CC1=C(C(=C2C(=C1)C(=C(C(=C2C#N)O)O)C(C)C)OC(=O)C(C)(C)C)C3=C(C=C4C(=C3OC(=O)C(C)(C)C)C(=C(C(=C4C(C)C)O)O)C#N)C

InChI

InChI=1S/C40H44N2O8/c1-17(2)25-21-13-19(5)27(35(49-37(47)39(7,8)9)29(21)23(15-41)31(43)33(25)45)28-20(6)14-22-26(18(3)4)34(46)32(44)24(16-42)30(22)36(28)50-38(48)40(10,11)12/h13-14,17-18,43-46H,1-12H3