(E)-3-[4-(1H-pyrazol-4-ylcarbonylamino)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(1H-pyrazol-4-ylcarbonylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(1H-pyrazole-4-carbonylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[oxo(1H-pyrazol-4-yl)methyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(1H-pyrazole-4-carbonylamino)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(1H-pyrazole-4-carbonylamino)phenyl]acrylic acid Formula: C13H11N3O3 MolecularWeight: 257.24474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)O)NC(=O)C2=CNN=C2

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)O)NC(=O)C2=CNN=C2

InChI

InChI=1S/C13H11N3O3/c17-12(18)6-3-9-1-4-11(5-2-9)16-13(19)10-7-14-15-8-10/h1-8H,(H,14,15)(H,16,19)(H,17,18)/b6-3+