sodium 2-cyclohexa-1,4-dien-1-yl-2-[[(Z)-4-methoxy-4-oxidanylidene-but-2-en-2-yl]amino]ethanoate

Systemtic Name: sodium 2-cyclohexa-1,4-dien-1-yl-2-[[(Z)-4-methoxy-4-oxidanylidene-but-2-en-2-yl]amino]ethanoate Openeye Name: sodium 2-cyclohexa-1,4-dien-1-yl-2-[[(Z)-3-methoxy-1-methyl-3-oxo-prop-1-enyl]amino]acetate CAS Name: sodium 2-(1-cyclohexa-1,4-dienyl)-2-[[(Z)-4-methoxy-4-oxobut-2-en-2-yl]amino]acetate IUPAC Name: sodium 2-cyclohexa-1,4-dien-1-yl-2-[[(Z)-4-methoxy-4-oxobut-2-en-2-yl]amino]acetate Traditional Name: sodium 2-cyclohexa-1,4-dien-1-yl-2-[[(Z)-3-keto-3-methoxy-1-methyl-prop-1-enyl]amino]acetate Formula: C13H16NNaO4 MolecularWeight: 273.26021

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OC)NC(C1=CCC=CC1)C(=O)[O-].[Na+]

Isomeric SMILES

C/C(=C/C(=O)OC)/NC(C1=CCC=CC1)C(=O)[O-].[Na+]

InChI

InChI=1S/C13H17NO4.Na/c1-9(8-11(15)18-2)14-12(13(16)17)10-6-4-3-5-7-10;/h3-4,7-8,12,14H,5-6H2,1-2H3,(H,16,17);/q;+1/p-1/b9-8-;