(E)-4-butyl-5-(hydroxymethyl)-2-methyl-oct-2-enoate

Systemtic Name: (E)-4-butyl-5-(hydroxymethyl)-2-methyl-oct-2-enoate Openeye Name: (E)-4-butyl-5-(hydroxymethyl)-2-methyl-oct-2-enoate CAS Name: (E)-4-butyl-5-(hydroxymethyl)-2-methyl-2-octenoate IUPAC Name: (E)-4-butyl-5-(hydroxymethyl)-2-methyloct-2-enoate Traditional Name: (E)-4-butyl-2-methyl-5-methylol-oct-2-enoate Formula: C14H25O3- MolecularWeight: 241.3465

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=C(C)C(=O)[O-])C(CCC)CO

Isomeric SMILES

CCCCC(/C=C(\C)/C(=O)[O-])C(CCC)CO

InChI

InChI=1S/C14H26O3/c1-4-6-8-12(9-11(3)14(16)17)13(10-15)7-5-2/h9,12-13,15H,4-8,10H2,1-3H3,(H,16,17)/p-1/b11-9+