ethanoic acid; (2E)-2-ethylidenecyclohexane-1-carboxylate

Systemtic Name: ethanoic acid; (2E)-2-ethylidenecyclohexane-1-carboxylate Openeye Name: acetic acid; (2E)-2-ethylidenecyclohexanecarboxylate CAS Name: acetic acid; (2E)-2-ethylidene-1-cyclohexanecarboxylate IUPAC Name: acetic acid; (2E)-2-ethylidenecyclohexane-1-carboxylate Traditional Name: acetic acid; (2E)-2-ethylidenecyclohexanecarboxylate Formula: C11H17O4- MolecularWeight: 213.25028

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Descriptors Computed from Structure

Canonical SMILES:

CC=C1CCCCC1C(=O)[O-].CC(=O)O

Isomeric SMILES

C/C=C/1\CCCCC1C(=O)[O-].CC(=O)O

InChI

InChI=1S/C9H14O2.C2H4O2/c1-2-7-5-3-4-6-8(7)9(10)11;1-2(3)4/h2,8H,3-6H2,1H3,(H,10,11);1H3,(H,3,4)/p-1/b7-2+;