4,5-bis(oxan-4-ylcarbonyloxy)-9,10-bis(oxidanylidene)-4a,9a-dihydroanthracene-2-carboxylic acid

Systemtic Name: 4,5-bis(oxan-4-ylcarbonyloxy)-9,10-bis(oxidanylidene)-4a,9a-dihydroanthracene-2-carboxylic acid Openeye Name: 9,10-dioxo-4,5-bis(tetrahydropyran-4-carbonyloxy)-4a,9a-dihydroanthracene-2-carboxylic acid CAS Name: 4,5-bis[4-oxanyl(oxo)methoxy]-9,10-dioxo-4a,9a-dihydroanthracene-2-carboxylic acid IUPAC Name: 4,5-bis(oxane-4-carbonyloxy)-9,10-dioxo-4a,9a-dihydroanthracene-2-carboxylic acid Traditional Name: 9,10-diketo-4,5-bis(tetrahydropyran-4-carbonyloxy)-4a,9a-dihydroanthracene-2-carboxylic acid Formula: C27H26O10 MolecularWeight: 510.48934

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)OC2=CC=CC3=C2C(=O)C4C(C3=O)C=C(C=C4OC(=O)C5CCOCC5)C(=O)O

Isomeric SMILES

C1COCCC1C(=O)OC2=CC=CC3=C2C(=O)C4C(C3=O)C=C(C=C4OC(=O)C5CCOCC5)C(=O)O

InChI

InChI=1S/C27H26O10/c28-23-17-2-1-3-19(36-26(32)14-4-8-34-9-5-14)21(17)24(29)22-18(23)12-16(25(30)31)13-20(22)37-27(33)15-6-10-35-11-7-15/h1-3,12-15,18,22H,4-11H2,(H,30,31)