tert-butyl 4-(3-chloranylpropyl)-7-oxidanylidene-hept-2-ynoate

Systemtic Name: tert-butyl 4-(3-chloranylpropyl)-7-oxidanylidene-hept-2-ynoate Openeye Name: tert-butyl 4-(3-chloropropyl)-7-oxo-hept-2-ynoate CAS Name: 4-(3-chloropropyl)-7-oxo-2-heptynoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-chloropropyl)-7-oxohept-2-ynoate Traditional Name: 4-(3-chloropropyl)-7-keto-hept-2-ynoic acid tert-butyl ester Formula: C14H21ClO3 MolecularWeight: 272.76774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21ClO3/c1-14(2,3)18-13(17)9-8-12(6-4-10-15)7-5-11-16/h11-12H,4-7,10H2,1-3H3