7-chloranyl-5-(2-fluorophenyl)-2-methoxy-4-oxidanidyl-3H-1,4-benzodiazepin-4-ium

Systemtic Name: 7-chloranyl-5-(2-fluorophenyl)-2-methoxy-4-oxidanidyl-3H-1,4-benzodiazepin-4-ium Openeye Name: 7-chloro-5-(2-fluorophenyl)-2-methoxy-4-oxido-3H-1,4-benzodiazepin-4-ium CAS Name: 7-chloro-5-(2-fluorophenyl)-2-methoxy-4-oxido-3H-1,4-benzodiazepin-4-ium IUPAC Name: 7-chloro-5-(2-fluorophenyl)-2-methoxy-4-oxido-3H-1,4-benzodiazepin-4-ium Traditional Name: 7-chloro-5-(2-fluorophenyl)-2-methoxy-4-oxido-3H-1,4-benzodiazepin-4-ium Formula: C16H12ClFN2O2 MolecularWeight: 318.730083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C=C(C=C2)Cl)C(=[N+](C1)[O-])C3=CC=CC=C3F

Isomeric SMILES

COC1=NC2=C(C=C(C=C2)Cl)C(=[N+](C1)[O-])C3=CC=CC=C3F

InChI

InChI=1S/C16H12ClFN2O2/c1-22-15-9-20(21)16(11-4-2-3-5-13(11)18)12-8-10(17)6-7-14(12)19-15/h2-8H,9H2,1H3