3-(4-cyanophenyl)-2-(prop-2-enoxycarbonylamino)propanoic acid

Systemtic Name: 3-(4-cyanophenyl)-2-(prop-2-enoxycarbonylamino)propanoic acid Openeye Name: 2-(allyloxycarbonylamino)-3-(4-cyanophenyl)propanoic acid CAS Name: 3-(4-cyanophenyl)-2-[[oxo(prop-2-enoxy)methyl]amino]propanoic acid IUPAC Name: 3-(4-cyanophenyl)-2-(prop-2-enoxycarbonylamino)propanoic acid Traditional Name: 2-(allyloxycarbonylamino)-3-(4-cyanophenyl)propionic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NC(CC1=CC=C(C=C1)C#N)C(=O)O

Isomeric SMILES

C=CCOC(=O)NC(CC1=CC=C(C=C1)C#N)C(=O)O

InChI

InChI=1S/C14H14N2O4/c1-2-7-20-14(19)16-12(13(17)18)8-10-3-5-11(9-15)6-4-10/h2-6,12H,1,7-8H2,(H,16,19)(H,17,18)