4-[3-(4-chlorophenyl)-4,5,6,7-tetrahydroindazol-2-yl]benzoate

Systemtic Name: 4-[3-(4-chlorophenyl)-4,5,6,7-tetrahydroindazol-2-yl]benzoate Openeye Name: 4-[3-(4-chlorophenyl)-4,5,6,7-tetrahydroindazol-2-yl]benzoate CAS Name: 4-[3-(4-chlorophenyl)-4,5,6,7-tetrahydroindazol-2-yl]benzoate IUPAC Name: 4-[3-(4-chlorophenyl)-4,5,6,7-tetrahydroindazol-2-yl]benzoate Traditional Name: 4-[3-(4-chlorophenyl)-4,5,6,7-tetrahydroindazol-2-yl]benzoate Formula: C20H16ClN2O2- MolecularWeight: 351.80624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NN(C(=C2C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1CCC2=NN(C(=C2C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C20H17ClN2O2/c21-15-9-5-13(6-10-15)19-17-3-1-2-4-18(17)22-23(19)16-11-7-14(8-12-16)20(24)25/h5-12H,1-4H2,(H,24,25)/p-1