2-[(E)-1-(2-azanylethylsulfonylamino)-3-phenyl-prop-2-enylidene]propanedioic acid

Systemtic Name: 2-[(E)-1-(2-azanylethylsulfonylamino)-3-phenyl-prop-2-enylidene]propanedioic acid Openeye Name: 2-[(E)-1-(2-aminoethylsulfonylamino)-3-phenyl-prop-2-enylidene]propanedioic acid CAS Name: 2-[(E)-1-(2-aminoethylsulfonylamino)-3-phenylprop-2-enylidene]propanedioic acid IUPAC Name: 2-[(E)-1-(2-aminoethylsulfonylamino)-3-phenylprop-2-enylidene]propanedioic acid Traditional Name: 2-[(E)-3-phenyl-1-(taurylamino)prop-2-enylidene]malonic acid Formula: C14H16N2O6S MolecularWeight: 340.35164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=C(C(=O)O)C(=O)O)NS(=O)(=O)CCN

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=C(C(=O)O)C(=O)O)NS(=O)(=O)CCN

InChI

InChI=1S/C14H16N2O6S/c15-8-9-23(21,22)16-11(12(13(17)18)14(19)20)7-6-10-4-2-1-3-5-10/h1-7,16H,8-9,15H2,(H,17,18)(H,19,20)/b7-6+