(2R)-3-(4-hydroxyphenyl)-2-[[(E)-4-methoxy-4-oxidanylidene-but-2-enoyl]amino]propanoic acid

Systemtic Name: (2R)-3-(4-hydroxyphenyl)-2-[[(E)-4-methoxy-4-oxidanylidene-but-2-enoyl]amino]propanoic acid Openeye Name: (2R)-3-(4-hydroxyphenyl)-2-[[(E)-4-methoxy-4-oxo-but-2-enoyl]amino]propanoic acid CAS Name: (2R)-3-(4-hydroxyphenyl)-2-[[(E)-4-methoxy-1,4-dioxobut-2-enyl]amino]propanoic acid IUPAC Name: (2R)-3-(4-hydroxyphenyl)-2-[[(E)-4-methoxy-4-oxobut-2-enoyl]amino]propanoic acid Traditional Name: (2R)-3-(4-hydroxyphenyl)-2-[[(E)-4-keto-4-methoxy-but-2-enoyl]amino]propionic acid Formula: C14H15NO6 MolecularWeight: 293.272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O

Isomeric SMILES

COC(=O)/C=C/C(=O)N[C@H](CC1=CC=C(C=C1)O)C(=O)O

InChI

InChI=1S/C14H15NO6/c1-21-13(18)7-6-12(17)15-11(14(19)20)8-9-2-4-10(16)5-3-9/h2-7,11,16H,8H2,1H3,(H,15,17)(H,19,20)/b7-6+/t11-/m1/s1