N-(4-butylphenyl)-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-(4-butylphenyl)-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-(4-butylphenyl)-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-(4-butylphenyl)-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-(4-butylphenyl)-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-(4-butylphenyl)-4-imidazol-1-yl-3-nitro-benzamide Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3/c1-2-3-4-15-5-8-17(9-6-15)22-20(25)16-7-10-18(19(13-16)24(26)27)23-12-11-21-14-23/h5-14H,2-4H2,1H3,(H,22,25)