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

Systemtic Name: 2-methyl-6-[[[3-(trifluoromethyl)phenyl]methylamino]methyl]-4H-1,4-benzoxazin-3-amine Openeye Name: 2-methyl-6-[[[3-(trifluoromethyl)phenyl]methylamino]methyl]-4H-1,4-benzoxazin-3-amine CAS Name: 2-methyl-6-[[[3-(trifluoromethyl)phenyl]methylamino]methyl]-4H-1,4-benzoxazin-3-amine IUPAC Name: 2-methyl-6-[[[3-(trifluoromethyl)phenyl]methylamino]methyl]-4H-1,4-benzoxazin-3-amine Traditional Name: (3-amino-2-methyl-4H-1,4-benzoxazin-6-yl)methyl-[3-(trifluoromethyl)benzyl]amine Formula: C18H18F3N3O MolecularWeight: 349.35023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C(O1)C=CC(=C2)CNCC3=CC(=CC=C3)C(F)(F)F)N

Isomeric SMILES

CC1=C(NC2=C(O1)C=CC(=C2)CNCC3=CC(=CC=C3)C(F)(F)F)N

InChI

InChI=1S/C18H18F3N3O/c1-11-17(22)24-15-8-13(5-6-16(15)25-11)10-23-9-12-3-2-4-14(7-12)18(19,20)21/h2-8,23-24H,9-10,22H2,1H3