5-ethyl-3-propyl-phthalic acid

Systemtic Name: 5-ethyl-3-propyl-phthalic acid Openeye Name: 5-ethyl-3-propyl-phthalic acid CAS Name: 5-ethyl-3-propylphthalic acid IUPAC Name: 5-ethyl-3-propylphthalic acid Traditional Name: 5-ethyl-3-propyl-phthalic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC(=C1)CC)C(=O)O)C(=O)O

Isomeric SMILES

CCCC1=C(C(=CC(=C1)CC)C(=O)O)C(=O)O

InChI

InChI=1S/C13H16O4/c1-3-5-9-6-8(4-2)7-10(12(14)15)11(9)13(16)17/h6-7H,3-5H2,1-2H3,(H,14,15)(H,16,17)