3-[(E)-2-(4-methylphenyl)ethenyl]-1-phenyl-cyclohepta[c]pyrazol-8-one

Systemtic Name: 3-[(E)-2-(4-methylphenyl)ethenyl]-1-phenyl-cyclohepta[c]pyrazol-8-one Openeye Name: 1-phenyl-3-[(E)-2-(p-tolyl)vinyl]cyclohepta[c]pyrazol-8-one CAS Name: 3-[(E)-2-(4-methylphenyl)ethenyl]-1-phenyl-8-cyclohepta[c]pyrazolone IUPAC Name: 3-[(E)-2-(4-methylphenyl)ethenyl]-1-phenylcyclohepta[c]pyrazol-8-one Traditional Name: 1-phenyl-3-[(E)-2-(p-tolyl)vinyl]cyclohepta[c]pyrazol-8-one Formula: C23H18N2O MolecularWeight: 338.40182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC2=NN(C3=C2C=CC=CC3=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C2=NN(C3=C2C=CC=CC3=O)C4=CC=CC=C4

InChI

InChI=1S/C23H18N2O/c1-17-11-13-18(14-12-17)15-16-21-20-9-5-6-10-22(26)23(20)25(24-21)19-7-3-2-4-8-19/h2-16H,1H3/b16-15+