N-[1-(3,4-diethoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C22H24N4O5 MolecularWeight: 424.44976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])OCC

InChI

InChI=1S/C22H24N4O5/c1-4-30-20-9-7-16(13-21(20)31-5-2)15(3)24-22(27)17-6-8-18(19(12-17)26(28)29)25-11-10-23-14-25/h6-15H,4-5H2,1-3H3,(H,24,27)