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

Systemtic Name: 3-[(E)-2-(3,4-dichlorophenyl)ethenyl]-1-phenyl-cyclohepta[c]pyrazol-8-one Openeye Name: 3-[(E)-2-(3,4-dichlorophenyl)vinyl]-1-phenyl-cyclohepta[c]pyrazol-8-one CAS Name: 3-[(E)-2-(3,4-dichlorophenyl)ethenyl]-1-phenyl-8-cyclohepta[c]pyrazolone IUPAC Name: 3-[(E)-2-(3,4-dichlorophenyl)ethenyl]-1-phenylcyclohepta[c]pyrazol-8-one Traditional Name: 3-[(E)-2-(3,4-dichlorophenyl)vinyl]-1-phenyl-cyclohepta[c]pyrazol-8-one Formula: C22H14Cl2N2O MolecularWeight: 393.26536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=CC=CC3=O)C(=N2)C=CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=CC=CC3=O)C(=N2)/C=C/C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H14Cl2N2O/c23-18-12-10-15(14-19(18)24)11-13-20-17-8-4-5-9-21(27)22(17)26(25-20)16-6-2-1-3-7-16/h1-14H/b13-11+