(2S)-1-[(2-phenethyl-1,3-benzoxazol-5-yl)carbonyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(2-phenethyl-1,3-benzoxazol-5-yl)carbonyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(2-phenethyl-1,3-benzoxazole-5-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-[oxo-(2-phenethyl-1,3-benzoxazol-5-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(2-phenethyl-1,3-benzoxazole-5-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(2-phenethyl-1,3-benzoxazole-5-carbonyl)pyrrolidine-2-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)OC(=N3)CCC4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC3=C(C=C2)OC(=N3)CCC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C21H21N3O3/c22-20(25)17-7-4-12-24(17)21(26)15-9-10-18-16(13-15)23-19(27-18)11-8-14-5-2-1-3-6-14/h1-3,5-6,9-10,13,17H,4,7-8,11-12H2,(H2,22,25)/t17-/m0/s1