tert-butyl 1-(2-azanyl-3,3-dimethyl-butanoyl)-4-(3-phenylmethoxypropoxy)pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-(2-azanyl-3,3-dimethyl-butanoyl)-4-(3-phenylmethoxypropoxy)pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-(2-amino-3,3-dimethyl-butanoyl)-4-(3-benzyloxypropoxy)pyrrolidine-2-carboxylate CAS Name: 1-(2-amino-3,3-dimethyl-1-oxobutyl)-4-(3-phenylmethoxypropoxy)-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(2-amino-3,3-dimethylbutanoyl)-4-(3-phenylmethoxypropoxy)pyrrolidine-2-carboxylate Traditional Name: 1-(2-amino-3,3-dimethyl-butanoyl)-4-(3-benzoxypropoxy)pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C25H40N2O5 MolecularWeight: 448.5955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CC(CC1C(=O)OC(C)(C)C)OCCCOCC2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)C(C(=O)N1CC(CC1C(=O)OC(C)(C)C)OCCCOCC2=CC=CC=C2)N

InChI

InChI=1S/C25H40N2O5/c1-24(2,3)21(26)22(28)27-16-19(15-20(27)23(29)32-25(4,5)6)31-14-10-13-30-17-18-11-8-7-9-12-18/h7-9,11-12,19-21H,10,13-17,26H2,1-6H3