5-(3-chlorophenyl)-3-fluoranyl-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one

Systemtic Name: 5-(3-chlorophenyl)-3-fluoranyl-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one Openeye Name: 5-(3-chlorophenyl)-3-fluoro-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one CAS Name: 5-(3-chlorophenyl)-3-fluoro-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one IUPAC Name: 5-(3-chlorophenyl)-3-fluoro-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one Traditional Name: 5-(3-chlorophenyl)-3-fluoro-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one Formula: C16H11ClFN3O3 MolecularWeight: 347.728243

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=NC(C1=O)F)C3=CC(=CC=C3)Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=NC(C1=O)F)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H11ClFN3O3/c1-20-13-6-5-11(21(23)24)8-12(13)14(19-15(18)16(20)22)9-3-2-4-10(17)7-9/h2-8,15H,1H3