N7,N7-diethyl-N4,2-bis(4-methylphenyl)-2-(trifluoromethyl)-1,3-benzoxazine-4,7-diamine

Systemtic Name: N7,N7-diethyl-N4,2-bis(4-methylphenyl)-2-(trifluoromethyl)-1,3-benzoxazine-4,7-diamine Openeye Name: N7,N7-diethyl-N4,2-bis(p-tolyl)-2-(trifluoromethyl)-1,3-benzoxazine-4,7-diamine CAS Name: N7,N7-diethyl-N4,2-bis(4-methylphenyl)-2-(trifluoromethyl)-1,3-benzoxazine-4,7-diamine IUPAC Name: 7-N,7-N-diethyl-4-N,2-bis(4-methylphenyl)-2-(trifluoromethyl)-1,3-benzoxazine-4,7-diamine Traditional Name: diethyl-[4-(p-toluidino)-2-(p-tolyl)-2-(trifluoromethyl)-1,3-benzoxazin-7-yl]amine Formula: C27H28F3N3O MolecularWeight: 467.52593

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=NC(O2)(C3=CC=C(C=C3)C)C(F)(F)F)NC4=CC=C(C=C4)C

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=NC(O2)(C3=CC=C(C=C3)C)C(F)(F)F)NC4=CC=C(C=C4)C

InChI

InChI=1S/C27H28F3N3O/c1-5-33(6-2)22-15-16-23-24(17-22)34-26(27(28,29)30,20-11-7-18(3)8-12-20)32-25(23)31-21-13-9-19(4)10-14-21/h7-17H,5-6H2,1-4H3,(H,31,32)