(E)-2-but-2-ynyl-3-methyl-hept-2-en-5-ynoic acid

Systemtic Name: (E)-2-but-2-ynyl-3-methyl-hept-2-en-5-ynoic acid Openeye Name: (E)-2-but-2-ynyl-3-methyl-hept-2-en-5-ynoic acid CAS Name: (E)-2-but-2-ynyl-3-methylhept-2-en-5-ynoic acid IUPAC Name: (E)-2-but-2-ynyl-3-methylhept-2-en-5-ynoic acid Traditional Name: (E)-2-but-2-ynyl-3-methyl-hept-2-en-5-ynoic acid Formula: C12H14O2 MolecularWeight: 190.23836

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(=C(CC#CC)C(=O)O)C

Isomeric SMILES

CC#CC/C(=C(\CC#CC)/C(=O)O)/C

InChI

InChI=1S/C12H14O2/c1-4-6-8-10(3)11(12(13)14)9-7-5-2/h8-9H2,1-3H3,(H,13,14)/b11-10+