tert-butyl N-[2-[2-[(2-chloranyl-4-cyano-phenyl)methylcarbamoyl]-2-cyclohexyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[2-[(2-chloranyl-4-cyano-phenyl)methylcarbamoyl]-2-cyclohexyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl]carbamate Openeye Name: tert-butyl N-[2-[2-[(2-chloro-4-cyano-phenyl)methylcarbamoyl]-2-cyclohexyl-pyrrolidin-1-yl]-2-oxo-ethyl]carbamate CAS Name: N-[2-[2-[[(2-chloro-4-cyanophenyl)methylamino]-oxomethyl]-2-cyclohexyl-1-pyrrolidinyl]-2-oxoethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[2-[(2-chloro-4-cyanophenyl)methylcarbamoyl]-2-cyclohexylpyrrolidin-1-yl]-2-oxoethyl]carbamate Traditional Name: N-[2-[2-[(2-chloro-4-cyano-benzyl)carbamoyl]-2-cyclohexyl-pyrrolidino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C26H35ClN4O4 MolecularWeight: 503.0335

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)N1CCCC1(C2CCCCC2)C(=O)NCC3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)N1CCCC1(C2CCCCC2)C(=O)NCC3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C26H35ClN4O4/c1-25(2,3)35-24(34)30-17-22(32)31-13-7-12-26(31,20-8-5-4-6-9-20)23(33)29-16-19-11-10-18(15-28)14-21(19)27/h10-11,14,20H,4-9,12-13,16-17H2,1-3H3,(H,29,33)(H,30,34)