4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohex-3-ene-1-carboxylic acid CAS Name: 4-[3-ethyl-1-(4-fluorophenyl)-6-indazolyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 4-[3-ethyl-1-(4-fluorophenyl)indazol-6-yl]cyclohex-3-ene-1-carboxylic acid Formula: C22H21FN2O2 MolecularWeight: 364.412743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21FN2O2/c1-2-20-19-12-7-16(14-3-5-15(6-4-14)22(26)27)13-21(19)25(24-20)18-10-8-17(23)9-11-18/h3,7-13,15H,2,4-6H2,1H3,(H,26,27)