(E)-1-(1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H18N2O3/c1-14-18(15(2)23(22-14)17-6-4-3-5-7-17)9-10-19(24)16-8-11-20-21(12-16)26-13-25-20/h3-12H,13H2,1-2H3/b10-9+