methyl 5-[1,8-bis(oxidanyl)-9-oxidanylidene-10H-anthracen-2-yl]pentanoate

Systemtic Name: methyl 5-[1,8-bis(oxidanyl)-9-oxidanylidene-10H-anthracen-2-yl]pentanoate Openeye Name: methyl 5-(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)pentanoate CAS Name: 5-(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)pentanoic acid methyl ester IUPAC Name: methyl 5-(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)pentanoate Traditional Name: 5-(1,8-dihydroxy-9-keto-10H-anthracen-2-yl)valeric acid methyl ester Formula: C20H20O5 MolecularWeight: 340.3698

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1=C(C2=C(CC3=C(C2=O)C(=CC=C3)O)C=C1)O

Isomeric SMILES

COC(=O)CCCCC1=C(C2=C(CC3=C(C2=O)C(=CC=C3)O)C=C1)O

InChI

InChI=1S/C20H20O5/c1-25-16(22)8-3-2-5-12-9-10-14-11-13-6-4-7-15(21)17(13)20(24)18(14)19(12)23/h4,6-7,9-10,21,23H,2-3,5,8,11H2,1H3