(E)-3-[4-[(1-methylpyrazol-4-yl)carbonylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(1-methylpyrazol-4-yl)carbonylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[(1-methylpyrazole-4-carbonyl)amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[(1-methyl-4-pyrazolyl)-oxomethyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(1-methylpyrazole-4-carbonyl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[(1-methylpyrazole-4-carbonyl)amino]phenyl]acrylic acid Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)NC2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

CN1C=C(C=N1)C(=O)NC2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C14H13N3O3/c1-17-9-11(8-15-17)14(20)16-12-5-2-10(3-6-12)4-7-13(18)19/h2-9H,1H3,(H,16,20)(H,18,19)/b7-4+