2-[[(E)-octadec-9-enyl]amino]butanoate

Systemtic Name: 2-[[(E)-octadec-9-enyl]amino]butanoate Openeye Name: 2-[[(E)-octadec-9-enyl]amino]butanoate CAS Name: 2-[[(E)-octadec-9-enyl]amino]butanoate IUPAC Name: 2-[[(E)-octadec-9-enyl]amino]butanoate Traditional Name: 2-[[(E)-octadec-9-enyl]amino]butyrate Formula: C22H42NO2- MolecularWeight: 352.57438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCNC(CC)C(=O)[O-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCNC(CC)C(=O)[O-]

InChI

InChI=1S/C22H43NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-21(4-2)22(24)25/h11-12,21,23H,3-10,13-20H2,1-2H3,(H,24,25)/p-1/b12-11+