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

Systemtic Name: sodium 2-[[(E)-octadec-9-enoyl]amino]ethanoic acid Openeye Name: sodium 2-[[(E)-octadec-9-enoyl]amino]acetic acid CAS Name: sodium 2-[[(E)-1-oxooctadec-9-enyl]amino]acetic acid IUPAC Name: sodium 2-[[(E)-octadec-9-enoyl]amino]acetic acid Traditional Name: sodium 2-[[(E)-octadec-9-enoyl]amino]acetic acid Formula: C20H37NNaO3+ MolecularWeight: 362.50245

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NCC(=O)O.[Na+]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NCC(=O)O.[Na+]

InChI

InChI=1S/C20H37NO3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(22)21-18-20(23)24;/h9-10H,2-8,11-18H2,1H3,(H,21,22)(H,23,24);/q;+1/b10-9+;