butanoate; heptanoate; hexanoate; pentanoate; propanoate; ethanoate

Systemtic Name: butanoate; heptanoate; hexanoate; pentanoate; propanoate; ethanoate Openeye Name: butanoate; heptanoate; hexanoate; pentanoate; propanoate; acetate CAS Name: butanoate; heptanoate; hexanoate; pentanoate; propanoate; acetate IUPAC Name: butanoate; heptanoate; hexanoate; pentanoate; propanoate; acetate Traditional Name: butyrate; enanthate; hexanoate; propionate; valerate; acetate Formula: C27H48O12-6 MolecularWeight: 564.66282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)[O-].CCCCCC(=O)[O-].CCCCC(=O)[O-].CCCC(=O)[O-].CCC(=O)[O-].CC(=O)[O-]

Isomeric SMILES

CCCCCCC(=O)[O-].CCCCCC(=O)[O-].CCCCC(=O)[O-].CCCC(=O)[O-].CCC(=O)[O-].CC(=O)[O-]

InChI

InChI=1S/C7H14O2.C6H12O2.C5H10O2.C4H8O2.C3H6O2.C2H4O2/c1-2-3-4-5-6-7(8)9;1-2-3-4-5-6(7)8;1-2-3-4-5(6)7;1-2-3-4(5)6;1-2-3(4)5;1-2(3)4/h2-6H2,1H3,(H,8,9);2-5H2,1H3,(H,7,8);2-4H2,1H3,(H,6,7);2-3H2,1H3,(H,5,6);2H2,1H3,(H,4,5);1H3,(H,3,4)/p-6