[2-methyl-4,5,7-tris(oxidanyl)-9,10-bis(oxidanylidene)anthracen-1-yl] benzoate

Systemtic Name: [2-methyl-4,5,7-tris(oxidanyl)-9,10-bis(oxidanylidene)anthracen-1-yl] benzoate Openeye Name: (4,5,7-trihydroxy-2-methyl-9,10-dioxo-1-anthryl) benzoate CAS Name: benzoic acid (4,5,7-trihydroxy-2-methyl-9,10-dioxo-1-anthracenyl) ester IUPAC Name: (4,5,7-trihydroxy-2-methyl-9,10-dioxoanthracen-1-yl) benzoate Traditional Name: benzoic acid (4,5,7-trihydroxy-9,10-diketo-2-methyl-1-anthryl) ester Formula: C22H14O7 MolecularWeight: 390.34236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1OC(=O)C3=CC=CC=C3)C(=O)C4=CC(=CC(=C4C2=O)O)O)O

Isomeric SMILES

CC1=CC(=C2C(=C1OC(=O)C3=CC=CC=C3)C(=O)C4=CC(=CC(=C4C2=O)O)O)O

InChI

InChI=1S/C22H14O7/c1-10-7-14(24)17-18(21(10)29-22(28)11-5-3-2-4-6-11)19(26)13-8-12(23)9-15(25)16(13)20(17)27/h2-9,23-25H,1H3