tert-butyl 2-[5,7-dimethoxy-4-oxidanyl-9,10-bis(oxidanylidene)-3-(3-oxidanylidenebutanoyl)anthracen-2-yl]ethanoate

Systemtic Name: tert-butyl 2-[5,7-dimethoxy-4-oxidanyl-9,10-bis(oxidanylidene)-3-(3-oxidanylidenebutanoyl)anthracen-2-yl]ethanoate Openeye Name: tert-butyl 2-[4-hydroxy-5,7-dimethoxy-9,10-dioxo-3-(3-oxobutanoyl)-2-anthryl]acetate CAS Name: 2-[3-(1,3-dioxobutyl)-4-hydroxy-5,7-dimethoxy-9,10-dioxo-2-anthracenyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-hydroxy-5,7-dimethoxy-9,10-dioxo-3-(3-oxobutanoyl)anthracen-2-yl]acetate Traditional Name: 2-(3-acetoacetyl-4-hydroxy-9,10-diketo-5,7-dimethoxy-2-anthryl)acetic acid tert-butyl ester Formula: C26H26O9 MolecularWeight: 482.47924

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C1=C(C=C2C(=C1O)C(=O)C3=C(C=C(C=C3C2=O)OC)OC)CC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)CC(=O)C1=C(C=C2C(=C1O)C(=O)C3=C(C=C(C=C3C2=O)OC)OC)CC(=O)OC(C)(C)C

InChI

InChI=1S/C26H26O9/c1-12(27)7-17(28)20-13(9-19(29)35-26(2,3)4)8-15-22(24(20)31)25(32)21-16(23(15)30)10-14(33-5)11-18(21)34-6/h8,10-11,31H,7,9H2,1-6H3