(E)-1-(azetidin-1-yl)-3-[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(azetidin-1-yl)-3-[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one Openeye Name: (E)-1-(azetidin-1-yl)-3-[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-1-(1-azetidinyl)-3-[3-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-(azetidin-1-yl)-3-[3-(3,4-dimethylphenyl)-1-phenylpyrazol-4-yl]prop-2-en-1-one Traditional Name: (E)-1-(azetidin-1-yl)-3-[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one Formula: C23H23N3O MolecularWeight: 357.44822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C=CC(=O)N3CCC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2/C=C/C(=O)N3CCC3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H23N3O/c1-17-9-10-19(15-18(17)2)23-20(11-12-22(27)25-13-6-14-25)16-26(24-23)21-7-4-3-5-8-21/h3-5,7-12,15-16H,6,13-14H2,1-2H3/b12-11+