5,7-dibutyl-12-chloranyl-tridec-12-en-8,10-diyn-6-one

Systemtic Name: 5,7-dibutyl-12-chloranyl-tridec-12-en-8,10-diyn-6-one Openeye Name: 5,7-dibutyl-12-chloro-tridec-12-en-8,10-diyn-6-one CAS Name: 5,7-dibutyl-12-chloro-6-tridec-12-en-8,10-diynone IUPAC Name: 5,7-dibutyl-12-chlorotridec-12-en-8,10-diyn-6-one Traditional Name: 5,7-dibutyl-12-chloro-tridec-12-en-8,10-diyn-6-one Formula: C21H31ClO MolecularWeight: 334.92324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)C(=O)C(CCCC)C#CC#CC(=C)Cl

Isomeric SMILES

CCCCC(CCCC)C(=O)C(CCCC)C#CC#CC(=C)Cl

InChI

InChI=1S/C21H31ClO/c1-5-8-14-19(15-9-6-2)21(23)20(16-10-7-3)17-12-11-13-18(4)22/h19-20H,4-10,14-16H2,1-3H3