N-(2-ethylphenyl)-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-(2-ethylphenyl)-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-(2-ethylphenyl)-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-(2-ethylphenyl)-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-(2-ethylphenyl)-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-(2-ethylphenyl)-4-imidazol-1-yl-3-nitro-benzamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O3/c1-2-13-5-3-4-6-15(13)20-18(23)14-7-8-16(17(11-14)22(24)25)21-10-9-19-12-21/h3-12H,2H2,1H3,(H,20,23)