N-[1-ethyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[1-ethyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[1-ethyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[1-ethyl-2-(1-pyrrolidinylmethyl)-5-benzimidazolyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[1-ethyl-2-(pyrrolidin-1-ylmethyl)benzimidazol-5-yl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[1-ethyl-2-(pyrrolidinomethyl)benzimidazol-5-yl]-2-(4-nitrophenoxy)acetamide Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-])N=C1CN4CCCC4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-])N=C1CN4CCCC4

InChI

InChI=1S/C22H25N5O4/c1-2-26-20-10-5-16(13-19(20)24-21(26)14-25-11-3-4-12-25)23-22(28)15-31-18-8-6-17(7-9-18)27(29)30/h5-10,13H,2-4,11-12,14-15H2,1H3,(H,23,28)