2,2-dimethyl-12-oxidanyl-heptadec-13-ynoic acid

Systemtic Name: 2,2-dimethyl-12-oxidanyl-heptadec-13-ynoic acid Openeye Name: 12-hydroxy-2,2-dimethyl-heptadec-13-ynoic acid CAS Name: 12-hydroxy-2,2-dimethyl-13-heptadecynoic acid IUPAC Name: 12-hydroxy-2,2-dimethylheptadec-13-ynoic acid Traditional Name: 12-hydroxy-2,2-dimethyl-heptadec-13-ynoic acid Formula: C19H34O3 MolecularWeight: 310.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC(CCCCCCCCCC(C)(C)C(=O)O)O

Isomeric SMILES

CCCC#CC(CCCCCCCCCC(C)(C)C(=O)O)O

InChI

InChI=1S/C19H34O3/c1-4-5-11-14-17(20)15-12-9-7-6-8-10-13-16-19(2,3)18(21)22/h17,20H,4-10,12-13,15-16H2,1-3H3,(H,21,22)