butanoate; phthalate; ethanoate

Systemtic Name: butanoate; phthalate; ethanoate Openeye Name: butanoate; phthalate; acetate CAS Name: butanoate; phthalate; acetate IUPAC Name: butanoate; phthalate; acetate Traditional Name: butyrate; phthalate; acetate Formula: C14H14O8-4 MolecularWeight: 310.25616

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[O-].CC(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCC(=O)[O-].CC(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C8H6O4.C4H8O2.C2H4O2/c9-7(10)5-3-1-2-4-6(5)8(11)12;1-2-3-4(5)6;1-2(3)4/h1-4H,(H,9,10)(H,11,12);2-3H2,1H3,(H,5,6);1H3,(H,3,4)/p-4