butyl 7-[9,10-bis(oxidanylidene)anthracen-2-yl]-3,7-dimethyl-octanoate

Systemtic Name: butyl 7-[9,10-bis(oxidanylidene)anthracen-2-yl]-3,7-dimethyl-octanoate Openeye Name: butyl 7-(9,10-dioxo-2-anthryl)-3,7-dimethyl-octanoate CAS Name: 7-(9,10-dioxo-2-anthracenyl)-3,7-dimethyloctanoic acid butyl ester IUPAC Name: butyl 7-(9,10-dioxoanthracen-2-yl)-3,7-dimethyloctanoate Traditional Name: 7-(9,10-diketo-2-anthryl)-3,7-dimethyl-caprylic acid butyl ester Formula: C28H34O4 MolecularWeight: 434.56716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC(C)CCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCOC(=O)CC(C)CCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C28H34O4/c1-5-6-16-32-25(29)17-19(2)10-9-15-28(3,4)20-13-14-23-24(18-20)27(31)22-12-8-7-11-21(22)26(23)30/h7-8,11-14,18-19H,5-6,9-10,15-17H2,1-4H3