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

Systemtic Name: [5-[9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexyl] ethanoate Openeye Name: [5-(9,10-dioxo-2-anthryl)-5-methyl-hexyl] acetate CAS Name: acetic acid [5-(9,10-dioxo-2-anthracenyl)-5-methylhexyl] ester IUPAC Name: [5-(9,10-dioxoanthracen-2-yl)-5-methylhexyl] acetate Traditional Name: acetic acid [5-(9,10-diketo-2-anthryl)-5-methyl-hexyl] ester Formula: C23H24O4 MolecularWeight: 364.43426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(=O)OCCCCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H24O4/c1-15(24)27-13-7-6-12-23(2,3)16-10-11-19-20(14-16)22(26)18-9-5-4-8-17(18)21(19)25/h4-5,8-11,14H,6-7,12-13H2,1-3H3