N-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-2-(7-nitrobenzimidazol-1-yl)ethanamide

Systemtic Name: N-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-2-(7-nitrobenzimidazol-1-yl)ethanamide Openeye Name: N-[2-(5-bromo-2-methoxy-phenyl)ethyl]-2-(7-nitrobenzimidazol-1-yl)acetamide CAS Name: N-[2-(5-bromo-2-methoxyphenyl)ethyl]-2-(7-nitro-1-benzimidazolyl)acetamide IUPAC Name: N-[2-(5-bromo-2-methoxyphenyl)ethyl]-2-(7-nitrobenzimidazol-1-yl)acetamide Traditional Name: N-[2-(5-bromo-2-methoxy-phenyl)ethyl]-2-(7-nitrobenzimidazol-1-yl)acetamide Formula: C18H17BrN4O4 MolecularWeight: 433.25598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CCNC(=O)CN2C=NC3=C2C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CCNC(=O)CN2C=NC3=C2C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17BrN4O4/c1-27-16-6-5-13(19)9-12(16)7-8-20-17(24)10-22-11-21-14-3-2-4-15(18(14)22)23(25)26/h2-6,9,11H,7-8,10H2,1H3,(H,20,24)