(1-methyl-4-oxidanylidene-5-pent-2-ynyl-cyclopent-2-en-1-yl) ethanoate

Systemtic Name: (1-methyl-4-oxidanylidene-5-pent-2-ynyl-cyclopent-2-en-1-yl) ethanoate Openeye Name: (1-methyl-4-oxo-5-pent-2-ynyl-cyclopent-2-en-1-yl) acetate CAS Name: acetic acid (1-methyl-4-oxo-5-pent-2-ynyl-1-cyclopent-2-enyl) ester IUPAC Name: (1-methyl-4-oxo-5-pent-2-ynylcyclopent-2-en-1-yl) acetate Traditional Name: acetic acid (4-keto-1-methyl-5-pent-2-ynyl-cyclopent-2-en-1-yl) ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCC1C(=O)C=CC1(C)OC(=O)C

Isomeric SMILES

CCC#CCC1C(=O)C=CC1(C)OC(=O)C

InChI

InChI=1S/C13H16O3/c1-4-5-6-7-11-12(15)8-9-13(11,3)16-10(2)14/h8-9,11H,4,7H2,1-3H3