4,6-bis(oxidanylidene)-12-propyl-pyrano[3,2-b]xanthene-2,8-dicarboxylic acid

Systemtic Name: 4,6-bis(oxidanylidene)-12-propyl-pyrano[3,2-b]xanthene-2,8-dicarboxylic acid Openeye Name: 4,6-dioxo-12-propyl-pyrano[3,2-b]xanthene-2,8-dicarboxylic acid CAS Name: 4,6-dioxo-12-propylpyrano[3,2-b]xanthene-2,8-dicarboxylic acid IUPAC Name: 4,6-dioxo-12-propylpyrano[3,2-b]xanthene-2,8-dicarboxylic acid Traditional Name: 4,6-diketo-12-propyl-pyrano[3,2-b]xanthene-2,8-dicarboxylic acid Formula: C21H14O8 MolecularWeight: 394.33106

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC3=C1OC4=C(C3=O)C=C(C=C4)C(=O)O)C(=O)C=C(O2)C(=O)O

Isomeric SMILES

CCCC1=C2C(=CC3=C1OC4=C(C3=O)C=C(C=C4)C(=O)O)C(=O)C=C(O2)C(=O)O

InChI

InChI=1S/C21H14O8/c1-2-3-10-18-11(14(22)8-16(29-18)21(26)27)7-13-17(23)12-6-9(20(24)25)4-5-15(12)28-19(10)13/h4-8H,2-3H2,1H3,(H,24,25)(H,26,27)