N2-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-phenyl-cyclohexane-1,2-diamine

Systemtic Name: N2-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-phenyl-cyclohexane-1,2-diamine Openeye Name: N2-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-phenyl-cyclohexane-1,2-diamine CAS Name: N2-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-phenylcyclohexane-1,2-diamine IUPAC Name: 2-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-phenylcyclohexane-1,2-diamine Traditional Name: (2-amino-2-phenyl-cyclohexyl)-[3,5-bis(trifluoromethyl)benzyl]amine Formula: C21H22F6N2 MolecularWeight: 416.403199

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)(C3=CC=CC=C3)N

Isomeric SMILES

C1CCC(C(C1)NCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)(C3=CC=CC=C3)N

InChI

InChI=1S/C21H22F6N2/c22-20(23,24)16-10-14(11-17(12-16)21(25,26)27)13-29-18-8-4-5-9-19(18,28)15-6-2-1-3-7-15/h1-3,6-7,10-12,18,29H,4-5,8-9,13,28H2