N-[1-(1H-benzimidazol-2-yl)ethyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)ethyl]-4-morpholino-3-nitro-benzamide Formula: C20H21N5O4 MolecularWeight: 395.41184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O4/c1-13(19-22-15-4-2-3-5-16(15)23-19)21-20(26)14-6-7-17(18(12-14)25(27)28)24-8-10-29-11-9-24/h2-7,12-13H,8-11H2,1H3,(H,21,26)(H,22,23)