3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one

Systemtic Name: 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one Openeye Name: 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one CAS Name: 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]-1-(2,4-dimethoxyphenyl)-2-propen-1-one IUPAC Name: 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one Traditional Name: 3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one Formula: C28H24N2O5 MolecularWeight: 468.50056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5)OC

InChI

InChI=1S/C28H24N2O5/c1-32-22-10-11-23(26(17-22)33-2)24(31)12-8-20-18-30(21-6-4-3-5-7-21)29-28(20)19-9-13-25-27(16-19)35-15-14-34-25/h3-13,16-18H,14-15H2,1-2H3