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

Systemtic Name: ethyl 5-[7-tert-butyl-9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C27H32O4 MolecularWeight: 420.54058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)CCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H32O4/c1-7-31-23(28)9-8-14-27(5,6)18-11-13-20-22(16-18)25(30)21-15-17(26(2,3)4)10-12-19(21)24(20)29/h10-13,15-16H,7-9,14H2,1-6H3