N-(4-bromanyl-2-fluoranyl-phenyl)-6-methoxy-7-[2-(1,2,3-triazol-1-yl)ethoxy]quinolin-4-amine

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-6-methoxy-7-[2-(1,2,3-triazol-1-yl)ethoxy]quinolin-4-amine Openeye Name: N-(4-bromo-2-fluoro-phenyl)-6-methoxy-7-[2-(triazol-1-yl)ethoxy]quinolin-4-amine CAS Name: N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[2-(1-triazolyl)ethoxy]-4-quinolinamine IUPAC Name: N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[2-(triazol-1-yl)ethoxy]quinolin-4-amine Traditional Name: (4-bromo-2-fluoro-phenyl)-[6-methoxy-7-[2-(triazol-1-yl)ethoxy]-4-quinolyl]amine Formula: C20H17BrFN5O2 MolecularWeight: 458.283683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OCCN3C=CN=N3)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OCCN3C=CN=N3)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C20H17BrFN5O2/c1-28-19-11-14-16(25-17-3-2-13(21)10-15(17)22)4-5-23-18(14)12-20(19)29-9-8-27-7-6-24-26-27/h2-7,10-12H,8-9H2,1H3,(H,23,25)