ditert-butyl (E)-6-(3-chloranylpropyl)non-2-en-7-ynedioate

Systemtic Name: ditert-butyl (E)-6-(3-chloranylpropyl)non-2-en-7-ynedioate Openeye Name: ditert-butyl (E)-6-(3-chloropropyl)non-2-en-7-ynedioate CAS Name: (E)-6-(3-chloropropyl)non-2-en-7-ynedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (E)-6-(3-chloropropyl)non-2-en-7-ynedioate Traditional Name: (E)-6-(3-chloropropyl)non-2-en-7-ynedioic acid ditert-butyl ester Formula: C20H31ClO4 MolecularWeight: 370.91074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31ClO4/c1-19(2,3)24-17(22)12-8-7-10-16(11-9-15-21)13-14-18(23)25-20(4,5)6/h8,12,16H,7,9-11,15H2,1-6H3/b12-8+