4-iodanyl-4-phenyl-undec-2-ynoic acid

Systemtic Name: 4-iodanyl-4-phenyl-undec-2-ynoic acid Openeye Name: 4-iodo-4-phenyl-undec-2-ynoic acid CAS Name: 4-iodo-4-phenyl-2-undecynoic acid IUPAC Name: 4-iodo-4-phenylundec-2-ynoic acid Traditional Name: 4-iodo-4-phenyl-undec-2-ynoic acid Formula: C17H21IO2 MolecularWeight: 384.25191

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C#CC(=O)O)(C1=CC=CC=C1)I

Isomeric SMILES

CCCCCCCC(C#CC(=O)O)(C1=CC=CC=C1)I

InChI

InChI=1S/C17H21IO2/c1-2-3-4-5-9-13-17(18,14-12-16(19)20)15-10-7-6-8-11-15/h6-8,10-11H,2-5,9,13H2,1H3,(H,19,20)