methyl (E)-7-[(5E)-3-chloranyl-5-[(E)-oct-2-enylidene]-4-oxidanylidene-cyclopent-2-en-1-yl]hept-5-enoate

Systemtic Name: methyl (E)-7-[(5E)-3-chloranyl-5-[(E)-oct-2-enylidene]-4-oxidanylidene-cyclopent-2-en-1-yl]hept-5-enoate Openeye Name: methyl (E)-7-[(5E)-3-chloro-5-[(E)-oct-2-enylidene]-4-oxo-cyclopent-2-en-1-yl]hept-5-enoate CAS Name: (E)-7-[(5E)-3-chloro-5-[(E)-oct-2-enylidene]-4-oxo-1-cyclopent-2-enyl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[(5E)-3-chloro-5-[(E)-oct-2-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate Traditional Name: (E)-7-[(5E)-3-chloro-4-keto-5-[(E)-oct-2-enylidene]cyclopent-2-en-1-yl]hept-5-enoic acid methyl ester Formula: C21H29ClO3 MolecularWeight: 364.90616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC=C1C(C=C(C1=O)Cl)CC=CCCCC(=O)OC

Isomeric SMILES

CCCCC/C=C/C=C/1\C(C=C(C1=O)Cl)C/C=C/CCCC(=O)OC

InChI

InChI=1S/C21H29ClO3/c1-3-4-5-6-7-11-14-18-17(16-19(22)21(18)24)13-10-8-9-12-15-20(23)25-2/h7-8,10-11,14,16-17H,3-6,9,12-13,15H2,1-2H3/b10-8+,11-7+,18-14+