2-[[(E)-octadec-9-enoyl]amino]hexanoic acid

Systemtic Name: 2-[[(E)-octadec-9-enoyl]amino]hexanoic acid Openeye Name: 2-[[(E)-octadec-9-enoyl]amino]hexanoic acid CAS Name: 2-[[(E)-1-oxooctadec-9-enyl]amino]hexanoic acid IUPAC Name: 2-[[(E)-octadec-9-enoyl]amino]hexanoic acid Traditional Name: 2-[[(E)-octadec-9-enoyl]amino]hexanoic acid Formula: C24H45NO3 MolecularWeight: 395.619

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC(CCCC)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC(CCCC)C(=O)O

InChI

InChI=1S/C24H45NO3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23(26)25-22(24(27)28)20-6-4-2/h12-13,22H,3-11,14-21H2,1-2H3,(H,25,26)(H,27,28)/b13-12+