1-methyl-7-nitro-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 1-methyl-7-nitro-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 1-methyl-7-nitro-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one CAS Name: 1-methyl-7-nitro-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-methyl-7-nitro-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one Traditional Name: 1-methyl-7-nitro-5-[2-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one Formula: C17H12F3N3O3 MolecularWeight: 363.29069

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C17H12F3N3O3/c1-22-14-7-6-10(23(25)26)8-12(14)16(21-9-15(22)24)11-4-2-3-5-13(11)17(18,19)20/h2-8H,9H2,1H3