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

Systemtic Name: methyl 2-[1,8-bis(oxidanyl)-9-oxidanylidene-10H-anthracen-2-yl]ethanoate Openeye Name: methyl 2-(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)acetate CAS Name: 2-(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)acetic acid methyl ester IUPAC Name: methyl 2-(1,8-dihydroxy-9-oxo-10H-anthracen-2-yl)acetate Traditional Name: 2-(1,8-dihydroxy-9-keto-10H-anthracen-2-yl)acetic acid methyl ester Formula: C17H14O5 MolecularWeight: 298.29006

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(C2=C(CC3=C(C2=O)C(=CC=C3)O)C=C1)O

Isomeric SMILES

COC(=O)CC1=C(C2=C(CC3=C(C2=O)C(=CC=C3)O)C=C1)O

InChI

InChI=1S/C17H14O5/c1-22-13(19)8-11-6-5-10-7-9-3-2-4-12(18)14(9)17(21)15(10)16(11)20/h2-6,18,20H,7-8H2,1H3