methyl (E,4R)-7-methyl-4-oxidanyl-oct-5-en-2-ynoate

Systemtic Name: methyl (E,4R)-7-methyl-4-oxidanyl-oct-5-en-2-ynoate Openeye Name: methyl (E,4R)-4-hydroxy-7-methyl-oct-5-en-2-ynoate CAS Name: (E,4R)-4-hydroxy-7-methyloct-5-en-2-ynoic acid methyl ester IUPAC Name: methyl (E,4R)-4-hydroxy-7-methyloct-5-en-2-ynoate Traditional Name: (E,4R)-4-hydroxy-7-methyl-oct-5-en-2-ynoic acid methyl ester Formula: C10H14O3 MolecularWeight: 182.21636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O3/c1-8(2)4-5-9(11)6-7-10(12)13-3/h4-5,8-9,11H,1-3H3/b5-4+/t9-/m1/s1