3-chloranyl-1-methyl-N-(3-phenethylphenyl)pyridin-4-imine; tris(fluoranyl)methanesulfonic acid

Systemtic Name: 3-chloranyl-1-methyl-N-(3-phenethylphenyl)pyridin-4-imine; tris(fluoranyl)methanesulfonic acid Openeye Name: 3-chloro-1-methyl-N-(3-phenethylphenyl)pyridin-4-imine; trifluoromethanesulfonic acid CAS Name: 3-chloro-1-methyl-N-(3-phenethylphenyl)-4-pyridinimine; trifluoromethanesulfonic acid IUPAC Name: 3-chloro-1-methyl-N-(3-phenethylphenyl)pyridin-4-imine; trifluoromethanesulfonic acid Traditional Name: (3-chloro-1-methyl-4-pyridylidene)-(3-phenethylphenyl)amine; triflic acid Formula: C21H20ClF3N2O3S MolecularWeight: 472.90831

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=NC2=CC=CC(=C2)CCC3=CC=CC=C3)C(=C1)Cl.C(F)(F)(F)S(=O)(=O)O

Isomeric SMILES

CN1C=CC(=NC2=CC=CC(=C2)CCC3=CC=CC=C3)C(=C1)Cl.C(F)(F)(F)S(=O)(=O)O

InChI

InChI=1S/C20H19ClN2.CHF3O3S/c1-23-13-12-20(19(21)15-23)22-18-9-5-8-17(14-18)11-10-16-6-3-2-4-7-16;2-1(3,4)8(5,6)7/h2-9,12-15H,10-11H2,1H3;(H,5,6,7)