5-butyl-7-chloranyl-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one

Systemtic Name: 5-butyl-7-chloranyl-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one Openeye Name: 5-butyl-7-chloro-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one CAS Name: 5-butyl-7-chloro-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one IUPAC Name: 5-butyl-7-chloro-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one Traditional Name: 5-butyl-7-chloro-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one Formula: C14H14ClF3N2O MolecularWeight: 318.72197

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2=C(C=CC(=C2)Cl)NC(=O)C=N1)C(F)(F)F

Isomeric SMILES

CCCCC1(C2=C(C=CC(=C2)Cl)NC(=O)C=N1)C(F)(F)F

InChI

InChI=1S/C14H14ClF3N2O/c1-2-3-6-13(14(16,17)18)10-7-9(15)4-5-11(10)20-12(21)8-19-13/h4-5,7-8H,2-3,6H2,1H3,(H,20,21)