3-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]-6-methyl-pyran-2,4-dione

Systemtic Name: 3-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]-6-methyl-pyran-2,4-dione Openeye Name: 3-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]-6-methyl-pyran-2,4-dione CAS Name: 3-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]-1-oxoprop-2-enyl]-6-methylpyran-2,4-dione IUPAC Name: 3-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]prop-2-enoyl]-6-methylpyran-2,4-dione Traditional Name: 3-[3-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]acryloyl]-6-methyl-pyran-2,4-quinone Formula: C26H20N2O6 MolecularWeight: 456.4468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)C=CC2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=O)C(C(=O)O1)C(=O)C=CC2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

InChI

InChI=1S/C26H20N2O6/c1-16-13-21(30)24(26(31)34-16)20(29)9-7-18-15-28(19-5-3-2-4-6-19)27-25(18)17-8-10-22-23(14-17)33-12-11-32-22/h2-10,13-15,24H,11-12H2,1H3