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

Systemtic Name: 9-bromanyl-5-(2-fluorophenyl)-1,3,3-trimethyl-7-nitro-1,4-benzodiazepin-2-one Openeye Name: 9-bromo-5-(2-fluorophenyl)-1,3,3-trimethyl-7-nitro-1,4-benzodiazepin-2-one CAS Name: 9-bromo-5-(2-fluorophenyl)-1,3,3-trimethyl-7-nitro-1,4-benzodiazepin-2-one IUPAC Name: 9-bromo-5-(2-fluorophenyl)-1,3,3-trimethyl-7-nitro-1,4-benzodiazepin-2-one Traditional Name: 9-bromo-5-(2-fluorophenyl)-1,3,3-trimethyl-7-nitro-1,4-benzodiazepin-2-one Formula: C18H15BrFN3O3 MolecularWeight: 420.232403

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(C=C(C=C2C(=N1)C3=CC=CC=C3F)[N+](=O)[O-])Br)C)C

Isomeric SMILES

CC1(C(=O)N(C2=C(C=C(C=C2C(=N1)C3=CC=CC=C3F)[N+](=O)[O-])Br)C)C

InChI

InChI=1S/C18H15BrFN3O3/c1-18(2)17(24)22(3)16-12(8-10(23(25)26)9-13(16)19)15(21-18)11-6-4-5-7-14(11)20/h4-9H,1-3H3