2-[(E)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]ethenyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(E)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]ethenyl]-1H-quinazolin-4-one Openeye Name: 2-[(E)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]vinyl]-1H-quinazolin-4-one CAS Name: 2-[(E)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]ethenyl]-1H-quinazolin-4-one IUPAC Name: 2-[(E)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]ethenyl]-1H-quinazolin-4-one Traditional Name: 2-[(E)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]vinyl]-1H-quinazolin-4-one Formula: C27H20N4O3 MolecularWeight: 448.4727

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C=CC4=NC(=O)C5=CC=CC=C5N4)C6=CC=CC=C6

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3/C=C/C4=NC(=O)C5=CC=CC=C5N4)C6=CC=CC=C6

InChI

InChI=1S/C27H20N4O3/c32-27-21-8-4-5-9-22(21)28-25(29-27)13-11-19-17-31(20-6-2-1-3-7-20)30-26(19)18-10-12-23-24(16-18)34-15-14-33-23/h1-13,16-17H,14-15H2,(H,28,29,32)/b13-11+