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

Systemtic Name: tert-butyl 4-(3-chloranylpropyl)-7,7-dimethoxy-hept-2-ynoate Openeye Name: tert-butyl 4-(3-chloropropyl)-7,7-dimethoxy-hept-2-ynoate CAS Name: 4-(3-chloropropyl)-7,7-dimethoxy-2-heptynoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-chloropropyl)-7,7-dimethoxyhept-2-ynoate Traditional Name: 4-(3-chloropropyl)-7,7-dimethoxy-hept-2-ynoic acid tert-butyl ester Formula: C16H27ClO4 MolecularWeight: 318.83618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27ClO4/c1-16(2,3)21-14(18)10-8-13(7-6-12-17)9-11-15(19-4)20-5/h13,15H,6-7,9,11-12H2,1-5H3