(E)-3-[4-[(1,5-dimethylpyrazol-4-yl)carbonylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(1,5-dimethylpyrazol-4-yl)carbonylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[(1,5-dimethylpyrazole-4-carbonyl)amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[(1,5-dimethyl-4-pyrazolyl)-oxomethyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(1,5-dimethylpyrazole-4-carbonyl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[(1,5-dimethylpyrazole-4-carbonyl)amino]phenyl]acrylic acid Formula: C15H15N3O3 MolecularWeight: 285.2979

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)NC2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

CC1=C(C=NN1C)C(=O)NC2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C15H15N3O3/c1-10-13(9-16-18(10)2)15(21)17-12-6-3-11(4-7-12)5-8-14(19)20/h3-9H,1-2H3,(H,17,21)(H,19,20)/b8-5+