4-heptyl-2,6-bis(oxidanyl)-3-(2-oxidanylidenepropyl)benzoic acid

Systemtic Name: 4-heptyl-2,6-bis(oxidanyl)-3-(2-oxidanylidenepropyl)benzoic acid Openeye Name: 3-acetonyl-4-heptyl-2,6-dihydroxy-benzoic acid CAS Name: 4-heptyl-2,6-dihydroxy-3-(2-oxopropyl)benzoic acid IUPAC Name: 4-heptyl-2,6-dihydroxy-3-(2-oxopropyl)benzoic acid Traditional Name: 3-acetonyl-4-heptyl-2,6-dihydroxy-benzoic acid Formula: C17H24O5 MolecularWeight: 308.36946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=C(C(=C1CC(=O)C)O)C(=O)O)O

Isomeric SMILES

CCCCCCCC1=CC(=C(C(=C1CC(=O)C)O)C(=O)O)O

InChI

InChI=1S/C17H24O5/c1-3-4-5-6-7-8-12-10-14(19)15(17(21)22)16(20)13(12)9-11(2)18/h10,19-20H,3-9H2,1-2H3,(H,21,22)