sodium 2,6-bis[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]hexanoate

Systemtic Name: sodium 2,6-bis[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]hexanoate Openeye Name: sodium 2,6-bis[[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]amino]hexanoate CAS Name: sodium 2,6-bis[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]hexanoate IUPAC Name: sodium 2,6-bis[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]hexanoate Traditional Name: sodium 2,6-bis[[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]amino]hexanoate Formula: C18H29N2NaO6 MolecularWeight: 392.42243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NCCCCC(C(=O)[O-])NC(=CC(=O)OCC)C.[Na+]

Isomeric SMILES

CCOC(=O)/C=C(\C)/NCCCCC(C(=O)[O-])N/C(=C/C(=O)OCC)/C.[Na+]

InChI

InChI=1S/C18H30N2O6.Na/c1-5-25-16(21)11-13(3)19-10-8-7-9-15(18(23)24)20-14(4)12-17(22)26-6-2;/h11-12,15,19-20H,5-10H2,1-4H3,(H,23,24);/q;+1/p-1/b13-11+,14-12+;