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3-azanyl-1-methyl-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one; hydron; bromide

3-azanyl-1-methyl-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one; hydron; bromide

Systemtic Name:3-azanyl-1-methyl-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one; hydron; bromide
Openeye Name:3-amino-1-methyl-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one; hydron; bromide
CAS Name:3-amino-1-methyl-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one; hydron; bromide
IUPAC Name:3-amino-1-methyl-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one; hydron; bromide
Traditional Name:3-amino-1-methyl-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one; hydron; bromide
Formula: C17H15BrF3N3O
MolecularWeight: 414.21971
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Descriptors Computed from Structure

Canonical SMILES:

[H+].CN1C2=CC=CC=C2C(=NC(C1=O)N)C3=CC=C(C=C3)C(F)(F)F.[Br-]


Isomeric SMILES

[H+].CN1C2=CC=CC=C2C(=NC(C1=O)N)C3=CC=C(C=C3)C(F)(F)F.[Br-]


InChI

InChI=1S/C17H14F3N3O.BrH/c1-23-13-5-3-2-4-12(13)14(22-15(21)16(23)24)10-6-8-11(9-7-10)17(18,19)20;/h2-9,15H,21H2,1H3;1H


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