3-cyano-5-ethyl-dodecanedioic acid

Systemtic Name: 3-cyano-5-ethyl-dodecanedioic acid Openeye Name: 3-cyano-5-ethyl-dodecanedioic acid CAS Name: 3-cyano-5-ethyldodecanedioic acid IUPAC Name: 3-cyano-5-ethyldodecanedioic acid Traditional Name: 3-cyano-5-ethyl-dodecanedioic acid Formula: C15H25NO4 MolecularWeight: 283.3633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCCCCC(=O)O)CC(CC(=O)O)C#N

Isomeric SMILES

CCC(CCCCCCC(=O)O)CC(CC(=O)O)C#N

InChI

InChI=1S/C15H25NO4/c1-2-12(9-13(11-16)10-15(19)20)7-5-3-4-6-8-14(17)18/h12-13H,2-10H2,1H3,(H,17,18)(H,19,20)