(E)-3-[3-methoxy-4-(propanoylamino)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-methoxy-4-(propanoylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-methoxy-4-(propanoylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-methoxy-4-(1-oxopropylamino)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-methoxy-4-(propanoylamino)phenyl]prop-2-enoic acid Traditional Name: (E)-3-(3-methoxy-4-propionamido-phenyl)acrylic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)C=CC(=O)O)OC

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)/C=C/C(=O)O)OC

InChI

InChI=1S/C13H15NO4/c1-3-12(15)14-10-6-4-9(5-7-13(16)17)8-11(10)18-2/h4-8H,3H2,1-2H3,(H,14,15)(H,16,17)/b7-5+