cyclohex-1-en-3-yne; methyl 2-[(E)-3-cyclopentyl-3-oxidanyl-prop-1-enyl]-4-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: cyclohex-1-en-3-yne; methyl 2-[(E)-3-cyclopentyl-3-oxidanyl-prop-1-enyl]-4-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: cyclohex-1-en-3-yne; methyl 2-[(E)-3-cyclopentyl-3-hydroxy-prop-1-enyl]-4-oxo-cyclopentanecarboxylate CAS Name: cyclohex-1-en-3-yne; 2-[(E)-3-cyclopentyl-3-hydroxyprop-1-enyl]-4-oxo-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: cyclohex-1-en-3-yne; methyl 2-[(E)-3-cyclopentyl-3-hydroxyprop-1-enyl]-4-oxocyclopentane-1-carboxylate Traditional Name: cyclohex-1-en-3-yne; 2-[(E)-3-cyclopentyl-3-hydroxy-prop-1-enyl]-4-keto-cyclopentanecarboxylic acid methyl ester Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=O)CC1C=CC(C2CCCC2)O.C1CC#CC=C1

Isomeric SMILES

COC(=O)C1CC(=O)CC1/C=C/C(C2CCCC2)O.C1CC#CC=C1

InChI

InChI=1S/C15H22O4.C6H6/c1-19-15(18)13-9-12(16)8-11(13)6-7-14(17)10-4-2-3-5-10;1-2-4-6-5-3-1/h6-7,10-11,13-14,17H,2-5,8-9H2,1H3;1-2H,3,5H2/b7-6+;