methyl 4-fluoranyl-3-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 4-fluoranyl-3-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzoate Openeye Name: methyl 4-fluoro-3-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzoate CAS Name: 4-fluoro-3-[[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzoate Traditional Name: 4-fluoro-3-[[(E)-3-(1-phenylpyrazol-4-yl)acryloyl]amino]benzoic acid methyl ester Formula: C20H16FN3O3 MolecularWeight: 365.357743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)F)NC(=O)C=CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)F)NC(=O)/C=C/C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H16FN3O3/c1-27-20(26)15-8-9-17(21)18(11-15)23-19(25)10-7-14-12-22-24(13-14)16-5-3-2-4-6-16/h2-13H,1H3,(H,23,25)/b10-7+