(E)-3-(1,3-dimethyl-5-phenoxy-pyrazol-4-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(1,3-dimethyl-5-phenoxy-pyrazol-4-yl)prop-2-enoic acid Openeye Name: (E)-3-(1,3-dimethyl-5-phenoxy-pyrazol-4-yl)prop-2-enoic acid CAS Name: (E)-3-(1,3-dimethyl-5-phenoxy-4-pyrazolyl)-2-propenoic acid IUPAC Name: (E)-3-(1,3-dimethyl-5-phenoxypyrazol-4-yl)prop-2-enoic acid Traditional Name: (E)-3-(1,3-dimethyl-5-phenoxy-pyrazol-4-yl)acrylic acid Formula: C14H14N2O3 MolecularWeight: 258.27256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)O)OC2=CC=CC=C2)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)O)OC2=CC=CC=C2)C

InChI

InChI=1S/C14H14N2O3/c1-10-12(8-9-13(17)18)14(16(2)15-10)19-11-6-4-3-5-7-11/h3-9H,1-2H3,(H,17,18)/b9-8+