N-(1-imidazol-1-ylpropyl)-4-nitro-benzamide

Systemtic Name: N-(1-imidazol-1-ylpropyl)-4-nitro-benzamide Openeye Name: N-(1-imidazol-1-ylpropyl)-4-nitro-benzamide CAS Name: N-[1-(1-imidazolyl)propyl]-4-nitrobenzamide IUPAC Name: N-(1-imidazol-1-ylpropyl)-4-nitrobenzamide Traditional Name: N-(1-imidazol-1-ylpropyl)-4-nitro-benzamide Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC(=O)C1=CC=C(C=C1)[N+](=O)[O-])N2C=CN=C2

Isomeric SMILES

CCC(NC(=O)C1=CC=C(C=C1)[N+](=O)[O-])N2C=CN=C2

InChI

InChI=1S/C13H14N4O3/c1-2-12(16-8-7-14-9-16)15-13(18)10-3-5-11(6-4-10)17(19)20/h3-9,12H,2H2,1H3,(H,15,18)