2-cyano-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-N-(3,4-dimethylphenyl)prop-2-enamide

Systemtic Name: 2-cyano-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-N-(3,4-dimethylphenyl)prop-2-enamide Openeye Name: 2-cyano-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-N-(3,4-dimethylphenyl)prop-2-enamide CAS Name: 2-cyano-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]-N-(3,4-dimethylphenyl)-2-propenamide IUPAC Name: 2-cyano-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]-N-(3,4-dimethylphenyl)prop-2-enamide Traditional Name: 2-cyano-3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-N-(3,4-dimethylphenyl)acrylamide Formula: C29H24N4O3 MolecularWeight: 476.52586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5)C#N)C

InChI

InChI=1S/C29H24N4O3/c1-19-8-10-24(14-20(19)2)31-29(34)22(17-30)15-23-18-33(25-6-4-3-5-7-25)32-28(23)21-9-11-26-27(16-21)36-13-12-35-26/h3-11,14-16,18H,12-13H2,1-2H3,(H,31,34)