(E)-3-(2,5-dimethylpyrazol-3-yl)-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(2,5-dimethylpyrazol-3-yl)-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(2,5-dimethylpyrazol-3-yl)-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one CAS Name: (E)-3-(2,5-dimethyl-3-pyrazolyl)-1-[4-(1-pyrrolyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(2,5-dimethylpyrazol-3-yl)-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(2,5-dimethylpyrazol-3-yl)-1-(4-pyrrol-1-ylphenyl)prop-2-en-1-one Formula: C18H17N3O MolecularWeight: 291.34708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C=CC(=O)C2=CC=C(C=C2)N3C=CC=C3)C

Isomeric SMILES

CC1=NN(C(=C1)/C=C/C(=O)C2=CC=C(C=C2)N3C=CC=C3)C

InChI

InChI=1S/C18H17N3O/c1-14-13-17(20(2)19-14)9-10-18(22)15-5-7-16(8-6-15)21-11-3-4-12-21/h3-13H,1-2H3/b10-9+