N-[3-methoxy-5-(oxolan-2-ylmethoxy)phenyl]-2-(7-nitrobenzimidazol-1-yl)ethanamide

Systemtic Name: N-[3-methoxy-5-(oxolan-2-ylmethoxy)phenyl]-2-(7-nitrobenzimidazol-1-yl)ethanamide Openeye Name: N-[3-methoxy-5-(tetrahydrofuran-2-ylmethoxy)phenyl]-2-(7-nitrobenzimidazol-1-yl)acetamide CAS Name: N-[3-methoxy-5-(2-oxolanylmethoxy)phenyl]-2-(7-nitro-1-benzimidazolyl)acetamide IUPAC Name: N-[3-methoxy-5-(oxolan-2-ylmethoxy)phenyl]-2-(7-nitrobenzimidazol-1-yl)acetamide Traditional Name: N-[3-methoxy-5-(tetrahydrofurfuryloxy)phenyl]-2-(7-nitrobenzimidazol-1-yl)acetamide Formula: C21H22N4O6 MolecularWeight: 426.42258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CN2C=NC3=C2C(=CC=C3)[N+](=O)[O-])OCC4CCCO4

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CN2C=NC3=C2C(=CC=C3)[N+](=O)[O-])OCC4CCCO4

InChI

InChI=1S/C21H22N4O6/c1-29-16-8-14(9-17(10-16)31-12-15-4-3-7-30-15)23-20(26)11-24-13-22-18-5-2-6-19(21(18)24)25(27)28/h2,5-6,8-10,13,15H,3-4,7,11-12H2,1H3,(H,23,26)