N-(benzotriazol-1-ylmethyl)-4-bromanyl-2-fluoranyl-aniline

Systemtic Name: N-(benzotriazol-1-ylmethyl)-4-bromanyl-2-fluoranyl-aniline Openeye Name: N-(benzotriazol-1-ylmethyl)-4-bromo-2-fluoro-aniline CAS Name: N-(1-benzotriazolylmethyl)-4-bromo-2-fluoroaniline IUPAC Name: N-(benzotriazol-1-ylmethyl)-4-bromo-2-fluoroaniline Traditional Name: benzotriazol-1-ylmethyl-(4-bromo-2-fluoro-phenyl)amine Formula: C13H10BrFN4 MolecularWeight: 321.147703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CNC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CNC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C13H10BrFN4/c14-9-5-6-11(10(15)7-9)16-8-19-13-4-2-1-3-12(13)17-18-19/h1-7,16H,8H2