4-(3-chlorophenyl)-6-(4-methylphenyl)-2,3a,4,5-tetrahydroindazol-3-one

Systemtic Name: 4-(3-chlorophenyl)-6-(4-methylphenyl)-2,3a,4,5-tetrahydroindazol-3-one Openeye Name: 4-(3-chlorophenyl)-6-(p-tolyl)-2,3a,4,5-tetrahydroindazol-3-one CAS Name: 4-(3-chlorophenyl)-6-(4-methylphenyl)-2,3a,4,5-tetrahydroindazol-3-one IUPAC Name: 4-(3-chlorophenyl)-6-(4-methylphenyl)-2,3a,4,5-tetrahydroindazol-3-one Traditional Name: 4-(3-chlorophenyl)-6-(p-tolyl)-2,3a,4,5-tetrahydroindazol-3-one Formula: C20H17ClN2O MolecularWeight: 336.81478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=NNC(=O)C3C(C2)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=NNC(=O)C3C(C2)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H17ClN2O/c1-12-5-7-13(8-6-12)15-10-17(14-3-2-4-16(21)9-14)19-18(11-15)22-23-20(19)24/h2-9,11,17,19H,10H2,1H3,(H,23,24)