[5-[6-(6-acetyloxy-2-methyl-hexan-2-yl)-9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexyl] ethanoate

Systemtic Name: [5-[6-(6-acetyloxy-2-methyl-hexan-2-yl)-9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexyl] ethanoate Openeye Name: [5-[6-(5-acetoxy-1,1-dimethyl-pentyl)-9,10-dioxo-2-anthryl]-5-methyl-hexyl] acetate CAS Name: acetic acid [5-[6-(6-acetyloxy-2-methylhexan-2-yl)-9,10-dioxo-2-anthracenyl]-5-methylhexyl] ester IUPAC Name: [5-[6-(6-acetyloxy-2-methylhexan-2-yl)-9,10-dioxoanthracen-2-yl]-5-methylhexyl] acetate Traditional Name: acetic acid [5-[6-(5-acetoxy-1,1-dimethyl-pentyl)-9,10-diketo-2-anthryl]-5-methyl-hexyl] ester Formula: C32H40O6 MolecularWeight: 520.6564

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=CC(=C3)C(C)(C)CCCCOC(=O)C

Isomeric SMILES

CC(=O)OCCCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=CC(=C3)C(C)(C)CCCCOC(=O)C

InChI

InChI=1S/C32H40O6/c1-21(33)37-17-9-7-15-31(3,4)23-11-13-25-27(19-23)29(35)26-14-12-24(20-28(26)30(25)36)32(5,6)16-8-10-18-38-22(2)34/h11-14,19-20H,7-10,15-18H2,1-6H3