5-(2-fluorophenyl)-1-methyl-7-nitro-3-propyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 5-(2-fluorophenyl)-1-methyl-7-nitro-3-propyl-3H-1,4-benzodiazepin-2-one Openeye Name: 5-(2-fluorophenyl)-1-methyl-7-nitro-3-propyl-3H-1,4-benzodiazepin-2-one CAS Name: 5-(2-fluorophenyl)-1-methyl-7-nitro-3-propyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 5-(2-fluorophenyl)-1-methyl-7-nitro-3-propyl-3H-1,4-benzodiazepin-2-one Traditional Name: 5-(2-fluorophenyl)-1-methyl-7-nitro-3-propyl-3H-1,4-benzodiazepin-2-one Formula: C19H18FN3O3 MolecularWeight: 355.362923

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3F)C

Isomeric SMILES

CCCC1C(=O)N(C2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3F)C

InChI

InChI=1S/C19H18FN3O3/c1-3-6-16-19(24)22(2)17-10-9-12(23(25)26)11-14(17)18(21-16)13-7-4-5-8-15(13)20/h4-5,7-11,16H,3,6H2,1-2H3