sodium 2-[ethyl-[(E)-octadec-9-enoyl]amino]ethanoate

Systemtic Name: sodium 2-[ethyl-[(E)-octadec-9-enoyl]amino]ethanoate Openeye Name: sodium 2-[ethyl-[(E)-octadec-9-enoyl]amino]acetate CAS Name: sodium 2-[ethyl-[(E)-1-oxooctadec-9-enyl]amino]acetate IUPAC Name: sodium 2-[ethyl-[(E)-octadec-9-enoyl]amino]acetate Traditional Name: sodium 2-[ethyl-[(E)-octadec-9-enoyl]amino]acetate Formula: C22H40NNaO3 MolecularWeight: 389.54767

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)N(CC)CC(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)N(CC)CC(=O)[O-].[Na+]

InChI

InChI=1S/C22H41NO3.Na/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(24)23(4-2)20-22(25)26;/h11-12H,3-10,13-20H2,1-2H3,(H,25,26);/q;+1/p-1/b12-11+;