3,4-dibutoxyphthalic acid

Systemtic Name: 3,4-dibutoxyphthalic acid Openeye Name: 3,4-dibutoxyphthalic acid CAS Name: 3,4-dibutoxyphthalic acid IUPAC Name: 3,4-dibutoxyphthalic acid Traditional Name: 3,4-dibutoxyphthalic acid Formula: C16H22O6 MolecularWeight: 310.34228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C=C1)C(=O)O)C(=O)O)OCCCC

Isomeric SMILES

CCCCOC1=C(C(=C(C=C1)C(=O)O)C(=O)O)OCCCC

InChI

InChI=1S/C16H22O6/c1-3-5-9-21-12-8-7-11(15(17)18)13(16(19)20)14(12)22-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3,(H,17,18)(H,19,20)