methyl (1R,2R,3R)-9-acetyloxy-8-methoxy-3-methyl-1-(3-methylbutyl)-4-oxidanylidene-2,3-dihydro-1H-anthracene-2-carboxylate

Systemtic Name: methyl (1R,2R,3R)-9-acetyloxy-8-methoxy-3-methyl-1-(3-methylbutyl)-4-oxidanylidene-2,3-dihydro-1H-anthracene-2-carboxylate Openeye Name: methyl (1R,2R,3R)-9-acetoxy-1-isopentyl-8-methoxy-3-methyl-4-oxo-2,3-dihydro-1H-anthracene-2-carboxylate CAS Name: (1R,2R,3R)-9-acetyloxy-8-methoxy-3-methyl-1-(3-methylbutyl)-4-oxo-2,3-dihydro-1H-anthracene-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,2R,3R)-9-acetyloxy-8-methoxy-3-methyl-1-(3-methylbutyl)-4-oxo-2,3-dihydro-1H-anthracene-2-carboxylate Traditional Name: (1R,2R,3R)-9-acetoxy-1-isoamyl-4-keto-8-methoxy-3-methyl-2,3-dihydro-1H-anthracene-2-carboxylic acid methyl ester Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C2=C(C1=O)C=C3C=CC=C(C3=C2OC(=O)C)OC)CCC(C)C)C(=O)OC

Isomeric SMILES

C[C@@H]1[C@@H]([C@H](C2=C(C1=O)C=C3C=CC=C(C3=C2OC(=O)C)OC)CCC(C)C)C(=O)OC

InChI

InChI=1S/C25H30O6/c1-13(2)10-11-17-20(25(28)30-6)14(3)23(27)18-12-16-8-7-9-19(29-5)21(16)24(22(17)18)31-15(4)26/h7-9,12-14,17,20H,10-11H2,1-6H3/t14-,17-,20+/m1/s1