(2S,3R)-2-methyl-3-oxidanyl-oct-7-ynoic acid

Systemtic Name: (2S,3R)-2-methyl-3-oxidanyl-oct-7-ynoic acid Openeye Name: (2S,3R)-3-hydroxy-2-methyl-oct-7-ynoic acid CAS Name: (2S,3R)-3-hydroxy-2-methyl-7-octynoic acid IUPAC Name: (2S,3R)-3-hydroxy-2-methyloct-7-ynoic acid Traditional Name: (2S,3R)-3-hydroxy-2-methyl-oct-7-ynoic acid Formula: C9H14O3 MolecularWeight: 170.20566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]([C@@H](CCCC#C)O)C(=O)O

InChI

InChI=1S/C9H14O3/c1-3-4-5-6-8(10)7(2)9(11)12/h1,7-8,10H,4-6H2,2H3,(H,11,12)/t7-,8+/m0/s1