1-[7-chloranyl-5-(2-fluorophenyl)-4-oxidanidyl-3H-1,4-benzodiazepin-4-ium-2-yl]-N-methoxy-1-nitro-methanimine

Systemtic Name: 1-[7-chloranyl-5-(2-fluorophenyl)-4-oxidanidyl-3H-1,4-benzodiazepin-4-ium-2-yl]-N-methoxy-1-nitro-methanimine Openeye Name: 1-[7-chloro-5-(2-fluorophenyl)-4-oxido-3H-1,4-benzodiazepin-4-ium-2-yl]-N-methoxy-1-nitro-methanimine CAS Name: 1-[7-chloro-5-(2-fluorophenyl)-4-oxido-3H-1,4-benzodiazepin-4-ium-2-yl]-N-methoxy-1-nitromethanimine IUPAC Name: 1-[7-chloro-5-(2-fluorophenyl)-4-oxido-3H-1,4-benzodiazepin-4-ium-2-yl]-N-methoxy-1-nitromethanimine Traditional Name: (E)-[[7-chloro-5-(2-fluorophenyl)-4-oxido-3H-1,4-benzodiazepin-4-ium-2-yl]-nitro-methylene]-methoxy-amine Formula: C17H12ClFN4O4 MolecularWeight: 390.752983

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=NC2=C(C=C(C=C2)Cl)C(=[N+](C1)[O-])C3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

CO/N=C(\C1=NC2=C(C=C(C=C2)Cl)C(=[N+](C1)[O-])C3=CC=CC=C3F)/[N+](=O)[O-]

InChI

InChI=1S/C17H12ClFN4O4/c1-27-21-17(23(25)26)15-9-22(24)16(11-4-2-3-5-13(11)19)12-8-10(18)6-7-14(12)20-15/h2-8H,9H2,1H3/b21-17+