ethyl 4-cyano-4-(1-cyclohexyl-3-ethyl-indazol-6-yl)cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-cyano-4-(1-cyclohexyl-3-ethyl-indazol-6-yl)cyclohexane-1-carboxylate Openeye Name: ethyl 4-cyano-4-(1-cyclohexyl-3-ethyl-indazol-6-yl)cyclohexanecarboxylate CAS Name: 4-cyano-4-(1-cyclohexyl-3-ethyl-6-indazolyl)-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-4-(1-cyclohexyl-3-ethylindazol-6-yl)cyclohexane-1-carboxylate Traditional Name: 4-cyano-4-(1-cyclohexyl-3-ethyl-indazol-6-yl)cyclohexanecarboxylic acid ethyl ester Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C=CC(=C2)C3(CCC(CC3)C(=O)OCC)C#N)C4CCCCC4

Isomeric SMILES

CCC1=NN(C2=C1C=CC(=C2)C3(CCC(CC3)C(=O)OCC)C#N)C4CCCCC4

InChI

InChI=1S/C25H33N3O2/c1-3-22-21-11-10-19(16-23(21)28(27-22)20-8-6-5-7-9-20)25(17-26)14-12-18(13-15-25)24(29)30-4-2/h10-11,16,18,20H,3-9,12-15H2,1-2H3