5-methyl-9-oxidanylidene-7-propanoyl-xanthene-2-carboxylic acid

Systemtic Name: 5-methyl-9-oxidanylidene-7-propanoyl-xanthene-2-carboxylic acid Openeye Name: 5-methyl-9-oxo-7-propanoyl-xanthene-2-carboxylic acid CAS Name: 5-methyl-9-oxo-7-(1-oxopropyl)-2-xanthenecarboxylic acid IUPAC Name: 5-methyl-9-oxo-7-propanoylxanthene-2-carboxylic acid Traditional Name: 9-keto-5-methyl-7-propionyl-xanthene-2-carboxylic acid Formula: C18H14O5 MolecularWeight: 310.30076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)C

Isomeric SMILES

CCC(=O)C1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)C

InChI

InChI=1S/C18H14O5/c1-3-14(19)11-6-9(2)17-13(8-11)16(20)12-7-10(18(21)22)4-5-15(12)23-17/h4-8H,3H2,1-2H3,(H,21,22)