4-[3-[2-(1,3-benzodioxol-5-yloxy)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[3-[2-(1,3-benzodioxol-5-yloxy)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[3-[2-(1,3-benzodioxol-5-yloxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[3-[2-(1,3-benzodioxol-5-yloxy)-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[3-[2-(1,3-benzodioxol-5-yloxy)acetyl]-2,5-dimethylpyrrol-1-yl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[3-[2-(1,3-benzodioxol-5-yloxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C)C(=O)COC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=C(N1C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C)C(=O)COC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H25N3O5/c1-16-12-21(22(30)14-32-20-10-11-23-24(13-20)34-15-33-23)17(2)28(16)25-18(3)27(4)29(26(25)31)19-8-6-5-7-9-19/h5-13H,14-15H2,1-4H3