(3aR,7aR)-6,7a-bis(4-chlorophenyl)-1,3-diphenyl-3a,5,6,7-tetrahydroindazol-4-one

Systemtic Name: (3aR,7aR)-6,7a-bis(4-chlorophenyl)-1,3-diphenyl-3a,5,6,7-tetrahydroindazol-4-one Openeye Name: (3aR,7aR)-6,7a-bis(4-chlorophenyl)-1,3-diphenyl-3a,5,6,7-tetrahydroindazol-4-one CAS Name: (3aR,7aR)-6,7a-bis(4-chlorophenyl)-1,3-diphenyl-3a,5,6,7-tetrahydroindazol-4-one IUPAC Name: (3aR,7aR)-6,7a-bis(4-chlorophenyl)-1,3-diphenyl-3a,5,6,7-tetrahydroindazol-4-one Traditional Name: (3aR,7aR)-6,7a-bis(4-chlorophenyl)-1,3-diphenyl-3a,5,6,7-tetrahydroindazol-4-one Formula: C31H24Cl2N2O MolecularWeight: 511.44106

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2(C(C1=O)C(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Cl

Isomeric SMILES

C1C(C[C@@]2([C@@H](C1=O)C(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C31H24Cl2N2O/c32-25-15-11-21(12-16-25)23-19-28(36)29-30(22-7-3-1-4-8-22)34-35(27-9-5-2-6-10-27)31(29,20-23)24-13-17-26(33)18-14-24/h1-18,23,29H,19-20H2/t23?,29-,31-/m0/s1