(2S)-N2-[4-(1,3-benzoxazol-2-yl)phenyl]-N1-ethyl-pyrrolidine-1,2-dicarboxamide

Systemtic Name: (2S)-N2-[4-(1,3-benzoxazol-2-yl)phenyl]-N1-ethyl-pyrrolidine-1,2-dicarboxamide Openeye Name: (2S)-N2-[4-(1,3-benzoxazol-2-yl)phenyl]-N1-ethyl-pyrrolidine-1,2-dicarboxamide CAS Name: (2S)-N2-[4-(1,3-benzoxazol-2-yl)phenyl]-N1-ethylpyrrolidine-1,2-dicarboxamide IUPAC Name: (2S)-2-N-[4-(1,3-benzoxazol-2-yl)phenyl]-1-N-ethylpyrrolidine-1,2-dicarboxamide Traditional Name: (2S)-N'-[4-(1,3-benzoxazol-2-yl)phenyl]-N-ethyl-pyrrolidine-1,2-dicarboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCNC(=O)N1CCC[C@H]1C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H22N4O3/c1-2-22-21(27)25-13-5-7-17(25)19(26)23-15-11-9-14(10-12-15)20-24-16-6-3-4-8-18(16)28-20/h3-4,6,8-12,17H,2,5,7,13H2,1H3,(H,22,27)(H,23,26)/t17-/m0/s1