2-[(3-chlorophenyl)methyl]-N-[(1-ethyl-5-oxidanylidene-pyrrolidin-3-yl)methyl]-1,3-benzoxazole-6-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)methyl]-N-[(1-ethyl-5-oxidanylidene-pyrrolidin-3-yl)methyl]-1,3-benzoxazole-6-carboxamide Openeye Name: 2-[(3-chlorophenyl)methyl]-N-[(1-ethyl-5-oxo-pyrrolidin-3-yl)methyl]-1,3-benzoxazole-6-carboxamide CAS Name: 2-[(3-chlorophenyl)methyl]-N-[(1-ethyl-5-oxo-3-pyrrolidinyl)methyl]-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-[(3-chlorophenyl)methyl]-N-[(1-ethyl-5-oxopyrrolidin-3-yl)methyl]-1,3-benzoxazole-6-carboxamide Traditional Name: 2-(3-chlorobenzyl)-N-[(1-ethyl-5-keto-pyrrolidin-3-yl)methyl]-1,3-benzoxazole-6-carboxamide Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CC1=O)CNC(=O)C2=CC3=C(C=C2)N=C(O3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CCN1CC(CC1=O)CNC(=O)C2=CC3=C(C=C2)N=C(O3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H22ClN3O3/c1-2-26-13-15(10-21(26)27)12-24-22(28)16-6-7-18-19(11-16)29-20(25-18)9-14-4-3-5-17(23)8-14/h3-8,11,15H,2,9-10,12-13H2,1H3,(H,24,28)