4-(4-chloranyl-2H-chromen-2-yl)-3-(4-methylphenyl)-1-phenyl-pyrazole

Systemtic Name: 4-(4-chloranyl-2H-chromen-2-yl)-3-(4-methylphenyl)-1-phenyl-pyrazole Openeye Name: 4-(4-chloro-2H-chromen-2-yl)-1-phenyl-3-(p-tolyl)pyrazole CAS Name: 4-(4-chloro-2H-1-benzopyran-2-yl)-3-(4-methylphenyl)-1-phenylpyrazole IUPAC Name: 4-(4-chloro-2H-chromen-2-yl)-3-(4-methylphenyl)-1-phenylpyrazole Traditional Name: 4-(4-chloro-2H-chromen-2-yl)-1-phenyl-3-(p-tolyl)pyrazole Formula: C25H19ClN2O MolecularWeight: 398.88416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C3C=C(C4=CC=CC=C4O3)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C3C=C(C4=CC=CC=C4O3)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H19ClN2O/c1-17-11-13-18(14-12-17)25-21(16-28(27-25)19-7-3-2-4-8-19)24-15-22(26)20-9-5-6-10-23(20)29-24/h2-16,24H,1H3