4-imidazol-1-yl-3-nitro-N-propyl-benzamide

Systemtic Name: 4-imidazol-1-yl-3-nitro-N-propyl-benzamide Openeye Name: 4-imidazol-1-yl-3-nitro-N-propyl-benzamide CAS Name: 4-(1-imidazolyl)-3-nitro-N-propylbenzamide IUPAC Name: 4-imidazol-1-yl-3-nitro-N-propylbenzamide Traditional Name: 4-imidazol-1-yl-3-nitro-N-propyl-benzamide Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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