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

Systemtic Name: 1-[1-[7-chloranyl-5-(2-fluorophenyl)-4-oxidanidyl-3H-1,4-benzodiazepin-4-ium-2-yl]aziridin-2-yl]-N-methoxy-methanimine Openeye Name: 1-[1-[7-chloro-5-(2-fluorophenyl)-4-oxido-3H-1,4-benzodiazepin-4-ium-2-yl]aziridin-2-yl]-N-methoxy-methanimine CAS Name: 1-[1-[7-chloro-5-(2-fluorophenyl)-4-oxido-3H-1,4-benzodiazepin-4-ium-2-yl]-2-aziridinyl]-N-methoxymethanimine IUPAC Name: 1-[1-[7-chloro-5-(2-fluorophenyl)-4-oxido-3H-1,4-benzodiazepin-4-ium-2-yl]aziridin-2-yl]-N-methoxymethanimine Traditional Name: (E)-[1-[7-chloro-5-(2-fluorophenyl)-4-oxido-3H-1,4-benzodiazepin-4-ium-2-yl]ethylenimin-2-yl]methylene-methoxy-amine Formula: C19H16ClFN4O2 MolecularWeight: 386.807343

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Descriptors Computed from Structure

Canonical SMILES:

CON=CC1CN1C2=NC3=C(C=C(C=C3)Cl)C(=[N+](C2)[O-])C4=CC=CC=C4F

Isomeric SMILES

CO/N=C/C1CN1C2=NC3=C(C=C(C=C3)Cl)C(=[N+](C2)[O-])C4=CC=CC=C4F

InChI

InChI=1S/C19H16ClFN4O2/c1-27-22-9-13-10-24(13)18-11-25(26)19(14-4-2-3-5-16(14)21)15-8-12(20)6-7-17(15)23-18/h2-9,13H,10-11H2,1H3/b22-9+