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

Systemtic Name: butyl 5-[7-tert-butyl-9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexanoate Openeye Name: butyl 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 butyl ester IUPAC Name: butyl 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 butyl ester Formula: C29H36O4 MolecularWeight: 448.59374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=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

CCCCOC(=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/C29H36O4/c1-7-8-16-33-25(30)10-9-15-29(5,6)20-12-14-22-24(18-20)27(32)23-17-19(28(2,3)4)11-13-21(23)26(22)31/h11-14,17-18H,7-10,15-16H2,1-6H3