(2R)-N-(2-benzamidoethyl)-1-(4-tert-butylphenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(2-benzamidoethyl)-1-(4-tert-butylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(2-benzamidoethyl)-1-(4-tert-butylbenzoyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-(2-benzamidoethyl)-1-[(4-tert-butylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(2-benzamidoethyl)-1-(4-tert-butylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: (2R)-N-(2-benzamidoethyl)-1-(4-tert-butylbenzoyl)pyrrolidine-2-carboxamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCCC2C(=O)NCCNC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCC[C@@H]2C(=O)NCCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H31N3O3/c1-25(2,3)20-13-11-19(12-14-20)24(31)28-17-7-10-21(28)23(30)27-16-15-26-22(29)18-8-5-4-6-9-18/h4-6,8-9,11-14,21H,7,10,15-17H2,1-3H3,(H,26,29)(H,27,30)/t21-/m1/s1