6-[[(2-chloranyl-6-fluoranyl-phenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride

Systemtic Name: 6-[[(2-chloranyl-6-fluoranyl-phenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride Openeye Name: 6-[[(2-chloro-6-fluoro-phenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride CAS Name: 6-[[(2-chloro-6-fluorophenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride IUPAC Name: 6-[[(2-chloro-6-fluorophenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride Traditional Name: (3-amino-2-methyl-4H-1,4-benzoxazin-6-yl)methyl-(2-chloro-6-fluoro-benzyl)amine dihydrochloride Formula: C17H19Cl3FN3O MolecularWeight: 406.709663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C(O1)C=CC(=C2)CNCC3=C(C=CC=C3Cl)F)N.Cl.Cl

Isomeric SMILES

CC1=C(NC2=C(O1)C=CC(=C2)CNCC3=C(C=CC=C3Cl)F)N.Cl.Cl

InChI

InChI=1S/C17H17ClFN3O.2ClH/c1-10-17(20)22-15-7-11(5-6-16(15)23-10)8-21-9-12-13(18)3-2-4-14(12)19;;/h2-7,21-22H,8-9,20H2,1H3;2*1H