ethyl (2E,4E,8Z)-9-chloranyl-2,4-dimethyl-nona-2,4,8-trien-6-ynoate

Systemtic Name: ethyl (2E,4E,8Z)-9-chloranyl-2,4-dimethyl-nona-2,4,8-trien-6-ynoate Openeye Name: ethyl (2E,4E,8Z)-9-chloro-2,4-dimethyl-nona-2,4,8-trien-6-ynoate CAS Name: (2E,4E,8Z)-9-chloro-2,4-dimethylnona-2,4,8-trien-6-ynoic acid ethyl ester IUPAC Name: ethyl (2E,4E,8Z)-9-chloro-2,4-dimethylnona-2,4,8-trien-6-ynoate Traditional Name: (2E,4E,8Z)-9-chloro-2,4-dimethyl-nona-2,4,8-trien-6-ynoic acid ethyl ester Formula: C13H15ClO2 MolecularWeight: 238.71

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC(=CC#CC=CCl)C)C

Isomeric SMILES

CCOC(=O)/C(=C/C(=C/C#C/C=C\Cl)/C)/C

InChI

InChI=1S/C13H15ClO2/c1-4-16-13(15)12(3)10-11(2)8-6-5-7-9-14/h7-10H,4H2,1-3H3/b9-7-,11-8+,12-10+