4-cyano-4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-cyano-4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohexane-1-carboxylic acid Openeye Name: 4-cyano-4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohexanecarboxylic acid CAS Name: 4-cyano-4-[3-ethyl-1-(4-fluorophenyl)-6-indazolyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-cyano-4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohexane-1-carboxylic acid Traditional Name: 4-cyano-4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohexanecarboxylic acid Formula: C23H22FN3O2 MolecularWeight: 391.438083

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C=CC(=C2)C3(CCC(CC3)C(=O)O)C#N)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=NN(C2=C1C=CC(=C2)C3(CCC(CC3)C(=O)O)C#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22FN3O2/c1-2-20-19-8-3-16(23(14-25)11-9-15(10-12-23)22(28)29)13-21(19)27(26-20)18-6-4-17(24)5-7-18/h3-8,13,15H,2,9-12H2,1H3,(H,28,29)