9-bromanyl-5-(2-fluorophenyl)-3,3-dimethyl-7-nitro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 9-bromanyl-5-(2-fluorophenyl)-3,3-dimethyl-7-nitro-1H-1,4-benzodiazepin-2-one Openeye Name: 9-bromo-5-(2-fluorophenyl)-3,3-dimethyl-7-nitro-1H-1,4-benzodiazepin-2-one CAS Name: 9-bromo-5-(2-fluorophenyl)-3,3-dimethyl-7-nitro-1H-1,4-benzodiazepin-2-one IUPAC Name: 9-bromo-5-(2-fluorophenyl)-3,3-dimethyl-7-nitro-1H-1,4-benzodiazepin-2-one Traditional Name: 9-bromo-5-(2-fluorophenyl)-3,3-dimethyl-7-nitro-1H-1,4-benzodiazepin-2-one Formula: C17H13BrFN3O3 MolecularWeight: 406.205823

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=C(C=C(C=C2C(=N1)C3=CC=CC=C3F)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1(C(=O)NC2=C(C=C(C=C2C(=N1)C3=CC=CC=C3F)[N+](=O)[O-])Br)C

InChI

InChI=1S/C17H13BrFN3O3/c1-17(2)16(23)20-15-11(7-9(22(24)25)8-12(15)18)14(21-17)10-5-3-4-6-13(10)19/h3-8H,1-2H3,(H,20,23)