4,5-bis(oxidanyl)-9,10-bis(oxidanylidene)-3-propyl-anthracene-2-carboxylate

Systemtic Name: 4,5-bis(oxidanyl)-9,10-bis(oxidanylidene)-3-propyl-anthracene-2-carboxylate Openeye Name: 4,5-dihydroxy-9,10-dioxo-3-propyl-anthracene-2-carboxylate CAS Name: 4,5-dihydroxy-9,10-dioxo-3-propyl-2-anthracenecarboxylate IUPAC Name: 4,5-dihydroxy-9,10-dioxo-3-propylanthracene-2-carboxylate Traditional Name: 4,5-dihydroxy-9,10-diketo-3-propyl-anthracene-2-carboxylate Formula: C18H13O6- MolecularWeight: 325.29222

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1O)C(=O)C3=C(C2=O)C=CC=C3O)C(=O)[O-]

Isomeric SMILES

CCCC1=C(C=C2C(=C1O)C(=O)C3=C(C2=O)C=CC=C3O)C(=O)[O-]

InChI

InChI=1S/C18H14O6/c1-2-4-8-10(18(23)24)7-11-14(16(8)21)17(22)13-9(15(11)20)5-3-6-12(13)19/h3,5-7,19,21H,2,4H2,1H3,(H,23,24)/p-1