tert-butyl N-[1-(2-cyano-5-cyclohexyl-phenyl)pyrrolidin-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-(2-cyano-5-cyclohexyl-phenyl)pyrrolidin-3-yl]carbamate Openeye Name: tert-butyl N-[1-(2-cyano-5-cyclohexyl-phenyl)pyrrolidin-3-yl]carbamate CAS Name: N-[1-(2-cyano-5-cyclohexylphenyl)-3-pyrrolidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(2-cyano-5-cyclohexylphenyl)pyrrolidin-3-yl]carbamate Traditional Name: N-[1-(2-cyano-5-cyclohexyl-phenyl)pyrrolidin-3-yl]carbamic acid tert-butyl ester Formula: C22H31N3O2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(C1)C2=C(C=CC(=C2)C3CCCCC3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(C1)C2=C(C=CC(=C2)C3CCCCC3)C#N

InChI

InChI=1S/C22H31N3O2/c1-22(2,3)27-21(26)24-19-11-12-25(15-19)20-13-17(9-10-18(20)14-23)16-7-5-4-6-8-16/h9-10,13,16,19H,4-8,11-12,15H2,1-3H3,(H,24,26)