[2-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl] octanoate

Systemtic Name: [2-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-yl] octanoate Openeye Name: (2-hydroxy-9,10-dioxo-1-anthryl) octanoate CAS Name: octanoic acid (2-hydroxy-9,10-dioxo-1-anthracenyl) ester IUPAC Name: (2-hydroxy-9,10-dioxoanthracen-1-yl) octanoate Traditional Name: caprylic acid (2-hydroxy-9,10-diketo-1-anthryl) ester Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=C(C=CC2=C1C(=O)C3=CC=CC=C3C2=O)O

Isomeric SMILES

CCCCCCCC(=O)OC1=C(C=CC2=C1C(=O)C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C22H22O5/c1-2-3-4-5-6-11-18(24)27-22-17(23)13-12-16-19(22)21(26)15-10-8-7-9-14(15)20(16)25/h7-10,12-13,23H,2-6,11H2,1H3