sodium methyl (E)-3-[[2-oxidanylidene-2-(4-oxidanylphenoxy)ethyl]amino]but-2-enoate

Systemtic Name: sodium methyl (E)-3-[[2-oxidanylidene-2-(4-oxidanylphenoxy)ethyl]amino]but-2-enoate Openeye Name: sodium methyl (E)-3-[[2-(4-hydroxyphenoxy)-2-oxo-ethyl]amino]but-2-enoate CAS Name: sodium (E)-3-[[2-(4-hydroxyphenoxy)-2-oxoethyl]amino]-2-butenoic acid methyl ester IUPAC Name: sodium methyl (E)-3-[[2-(4-hydroxyphenoxy)-2-oxoethyl]amino]but-2-enoate Traditional Name: sodium (E)-3-[[2-(4-hydroxyphenoxy)-2-keto-ethyl]amino]but-2-enoic acid methyl ester Formula: C13H15NNaO5+ MolecularWeight: 288.25167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OC)NCC(=O)OC1=CC=C(C=C1)O.[Na+]

Isomeric SMILES

C/C(=C\C(=O)OC)/NCC(=O)OC1=CC=C(C=C1)O.[Na+]

InChI

InChI=1S/C13H15NO5.Na/c1-9(7-12(16)18-2)14-8-13(17)19-11-5-3-10(15)4-6-11;/h3-7,14-15H,8H2,1-2H3;/q;+1/b9-7+;