ethyl 2-(4-tert-butyl-1-phenyl-cyclohexyl)-2-cyano-ethanoate

Systemtic Name: ethyl 2-(4-tert-butyl-1-phenyl-cyclohexyl)-2-cyano-ethanoate Openeye Name: ethyl 2-(4-tert-butyl-1-phenyl-cyclohexyl)-2-cyano-acetate CAS Name: 2-(4-tert-butyl-1-phenylcyclohexyl)-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl 2-(4-tert-butyl-1-phenylcyclohexyl)-2-cyanoacetate Traditional Name: 2-(4-tert-butyl-1-phenyl-cyclohexyl)-2-cyano-acetic acid ethyl ester Formula: C21H29NO2 MolecularWeight: 327.46046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1(CCC(CC1)C(C)(C)C)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C#N)C1(CCC(CC1)C(C)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C21H29NO2/c1-5-24-19(23)18(15-22)21(17-9-7-6-8-10-17)13-11-16(12-14-21)20(2,3)4/h6-10,16,18H,5,11-14H2,1-4H3