(Z)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (Z)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide Openeye Name: (Z)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide CAS Name: (Z)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1,3-diphenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (Z)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide Traditional Name: (Z)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1,3-diphenylpyrazol-4-yl)acrylamide Formula: C27H20N4O3 MolecularWeight: 448.4727

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)C(=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)/C(=C\C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C27H20N4O3/c28-17-20(27(32)29-22-11-12-24-25(16-22)34-14-13-33-24)15-21-18-31(23-9-5-2-6-10-23)30-26(21)19-7-3-1-4-8-19/h1-12,15-16,18H,13-14H2,(H,29,32)/b20-15-