tert-butyl 4-(4-aminophenyl)carbonyloxy-2-(2-cyanopyrrolidin-1-yl)carbonyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-aminophenyl)carbonyloxy-2-(2-cyanopyrrolidin-1-yl)carbonyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(4-aminobenzoyl)oxy-2-(2-cyanopyrrolidine-1-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[(4-aminophenyl)-oxomethoxy]-2-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-aminobenzoyl)oxy-2-(2-cyanopyrrolidine-1-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(4-aminobenzoyl)oxy-2-(2-cyanopyrrolidine-1-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2C#N)OC(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2C#N)OC(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C22H28N4O5/c1-22(2,3)31-21(29)26-13-17(30-20(28)14-6-8-15(24)9-7-14)11-18(26)19(27)25-10-4-5-16(25)12-23/h6-9,16-18H,4-5,10-11,13,24H2,1-3H3