azocan-1-yl-(4-imidazol-1-yl-3-nitro-phenyl)methanone

Systemtic Name: azocan-1-yl-(4-imidazol-1-yl-3-nitro-phenyl)methanone Openeye Name: azocan-1-yl-(4-imidazol-1-yl-3-nitro-phenyl)methanone CAS Name: 1-azocanyl-[4-(1-imidazolyl)-3-nitrophenyl]methanone IUPAC Name: azocan-1-yl-(4-imidazol-1-yl-3-nitrophenyl)methanone Traditional Name: azocan-1-yl-(4-imidazol-1-yl-3-nitro-phenyl)methanone Formula: C17H20N4O3 MolecularWeight: 328.3657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CCC1)C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O3/c22-17(19-9-4-2-1-3-5-10-19)14-6-7-15(16(12-14)21(23)24)20-11-8-18-13-20/h6-8,11-13H,1-5,9-10H2