methyl 5-[7-tert-butyl-9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexanoate

Systemtic Name: methyl 5-[7-tert-butyl-9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexanoate Openeye Name: methyl 5-(7-tert-butyl-9,10-dioxo-2-anthryl)-5-methyl-hexanoate CAS Name: 5-(7-tert-butyl-9,10-dioxo-2-anthracenyl)-5-methylhexanoic acid methyl ester IUPAC Name: methyl 5-(7-tert-butyl-9,10-dioxoanthracen-2-yl)-5-methylhexanoate Traditional Name: 5-(7-tert-butyl-9,10-diketo-2-anthryl)-5-methyl-hexanoic acid methyl ester Formula: C26H30O4 MolecularWeight: 406.514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(C)(C)CCCC(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(C)(C)CCCC(=O)OC

InChI

InChI=1S/C26H30O4/c1-25(2,3)16-9-11-18-20(14-16)24(29)21-15-17(10-12-19(21)23(18)28)26(4,5)13-7-8-22(27)30-6/h9-12,14-15H,7-8,13H2,1-6H3