3-azanyl-4-[(5-bromanyl-2-fluoranyl-phenyl)amino]benzenecarbonitrile

Systemtic Name: 3-azanyl-4-[(5-bromanyl-2-fluoranyl-phenyl)amino]benzenecarbonitrile Openeye Name: 3-amino-4-(5-bromo-2-fluoro-anilino)benzonitrile CAS Name: 3-amino-4-(5-bromo-2-fluoroanilino)benzonitrile IUPAC Name: 3-amino-4-(5-bromo-2-fluoroanilino)benzonitrile Traditional Name: 3-amino-4-(5-bromo-2-fluoro-anilino)benzonitrile Formula: C13H9BrFN3 MolecularWeight: 306.133063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)N)NC2=C(C=CC(=C2)Br)F

Isomeric SMILES

C1=CC(=C(C=C1C#N)N)NC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C13H9BrFN3/c14-9-2-3-10(15)13(6-9)18-12-4-1-8(7-16)5-11(12)17/h1-6,18H,17H2