(2S,4S)-4-[(2,5-dimethylphenyl)methylamino]-N-ethyl-1-(phenylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S,4S)-4-[(2,5-dimethylphenyl)methylamino]-N-ethyl-1-(phenylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S,4S)-1-benzyl-4-[(2,5-dimethylphenyl)methylamino]-N-ethyl-pyrrolidine-2-carboxamide CAS Name: (2S,4S)-4-[(2,5-dimethylphenyl)methylamino]-N-ethyl-1-(phenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S,4S)-1-benzyl-4-[(2,5-dimethylphenyl)methylamino]-N-ethylpyrrolidine-2-carboxamide Traditional Name: (2S,4S)-1-benzyl-4-[(2,5-dimethylbenzyl)amino]-N-ethyl-pyrrolidine-2-carboxamide Formula: C23H31N3O MolecularWeight: 365.51174

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CC(CN1CC2=CC=CC=C2)NCC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCNC(=O)[C@@H]1C[C@@H](CN1CC2=CC=CC=C2)NCC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H31N3O/c1-4-24-23(27)22-13-21(16-26(22)15-19-8-6-5-7-9-19)25-14-20-12-17(2)10-11-18(20)3/h5-12,21-22,25H,4,13-16H2,1-3H3,(H,24,27)/t21-,22-/m0/s1