4-ethanoyl-3-methanoyl-non-6-ynoate

Systemtic Name: 4-ethanoyl-3-methanoyl-non-6-ynoate Openeye Name: 4-acetyl-3-formyl-non-6-ynoate CAS Name: 4-acetyl-3-formyl-6-nonynoate IUPAC Name: 4-acetyl-3-formylnon-6-ynoate Traditional Name: 4-acetyl-3-formyl-non-6-ynoate Formula: C12H15O4- MolecularWeight: 223.2451

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCC(C(CC(=O)[O-])C=O)C(=O)C

Isomeric SMILES

CCC#CCC(C(CC(=O)[O-])C=O)C(=O)C

InChI

InChI=1S/C12H16O4/c1-3-4-5-6-11(9(2)14)10(8-13)7-12(15)16/h8,10-11H,3,6-7H2,1-2H3,(H,15,16)/p-1