1-[(E)-octadec-9-enoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(E)-octadec-9-enoyl]piperidine-4-carboxylic acid Openeye Name: 1-[(E)-octadec-9-enoyl]piperidine-4-carboxylic acid CAS Name: 1-[(E)-1-oxooctadec-9-enyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(E)-octadec-9-enoyl]piperidine-4-carboxylic acid Traditional Name: 1-[(E)-octadec-9-enoyl]isonipecotic acid Formula: C24H43NO3 MolecularWeight: 393.60312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)N1CCC(CC1)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)N1CCC(CC1)C(=O)O

InChI

InChI=1S/C24H43NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)25-20-18-22(19-21-25)24(27)28/h9-10,22H,2-8,11-21H2,1H3,(H,27,28)/b10-9+