sodium (2R)-2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]-2-(4-hydroxyphenyl)ethanoate

Systemtic Name: sodium (2R)-2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]-2-(4-hydroxyphenyl)ethanoate Openeye Name: sodium (2R)-2-[[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]amino]-2-(4-hydroxyphenyl)acetate CAS Name: sodium (2R)-2-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]-2-(4-hydroxyphenyl)acetate IUPAC Name: sodium (2R)-2-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]-2-(4-hydroxyphenyl)acetate Traditional Name: sodium (2R)-2-[[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]amino]-2-(4-hydroxyphenyl)acetate Formula: C14H16NNaO5 MolecularWeight: 301.27031

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(C1=CC=C(C=C1)O)C(=O)[O-].[Na+]

Isomeric SMILES

CCOC(=O)/C=C(\C)/N[C@H](C1=CC=C(C=C1)O)C(=O)[O-].[Na+]

InChI

InChI=1S/C14H17NO5.Na/c1-3-20-12(17)8-9(2)15-13(14(18)19)10-4-6-11(16)7-5-10;/h4-8,13,15-16H,3H2,1-2H3,(H,18,19);/q;+1/p-1/b9-8+;/t13-;/m1./s1