(E,3R)-19-methylicos-4-en-1-yn-3-ol

Systemtic Name: (E,3R)-19-methylicos-4-en-1-yn-3-ol Openeye Name: (E,3R)-19-methylicos-4-en-1-yn-3-ol CAS Name: (E,3R)-19-methyl-3-eicos-4-en-1-ynol IUPAC Name: (E,3R)-19-methylicos-4-en-1-yn-3-ol Traditional Name: (E,3R)-19-methyleicos-4-en-1-yn-3-ol Formula: C21H38O MolecularWeight: 306.52582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCC=CC(C#C)O

Isomeric SMILES

CC(C)CCCCCCCCCCCCC/C=C/[C@H](C#C)O

InChI

InChI=1S/C21H38O/c1-4-21(22)19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20(2)3/h1,17,19-22H,5-16,18H2,2-3H3/b19-17+/t21-/m0/s1