3-[3-(4-methoxyphenyl)-4-[(E)-2-quinolin-2-ylethenyl]pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[3-(4-methoxyphenyl)-4-[(E)-2-quinolin-2-ylethenyl]pyrazol-1-yl]propanenitrile Openeye Name: 3-[3-(4-methoxyphenyl)-4-[(E)-2-(2-quinolyl)vinyl]pyrazol-1-yl]propanenitrile CAS Name: 3-[3-(4-methoxyphenyl)-4-[(E)-2-(2-quinolinyl)ethenyl]-1-pyrazolyl]propanenitrile IUPAC Name: 3-[3-(4-methoxyphenyl)-4-[(E)-2-quinolin-2-ylethenyl]pyrazol-1-yl]propanenitrile Traditional Name: 3-[3-(4-methoxyphenyl)-4-[(E)-2-(2-quinolyl)vinyl]pyrazol-1-yl]propionitrile Formula: C24H20N4O MolecularWeight: 380.4418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C=CC3=NC4=CC=CC=C4C=C3)CCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2/C=C/C3=NC4=CC=CC=C4C=C3)CCC#N

InChI

InChI=1S/C24H20N4O/c1-29-22-13-9-19(10-14-22)24-20(17-28(27-24)16-4-15-25)8-12-21-11-7-18-5-2-3-6-23(18)26-21/h2-3,5-14,17H,4,16H2,1H3/b12-8+