2-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-cyano-3-(4-methoxyphenyl)guanidine

Systemtic Name: 2-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-cyano-3-(4-methoxyphenyl)guanidine Openeye Name: 2-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-cyano-3-(4-methoxyphenyl)guanidine CAS Name: 2-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-cyano-3-(4-methoxyphenyl)guanidine IUPAC Name: 2-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-cyano-3-(4-methoxyphenyl)guanidine Traditional Name: 2-[3,5-bis(trifluoromethyl)benzyl]-1-cyano-3-(4-methoxyphenyl)guanidine Formula: C18H14F6N4O MolecularWeight: 416.320379

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=NCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)NC#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=NCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)NC#N

InChI

InChI=1S/C18H14F6N4O/c1-29-15-4-2-14(3-5-15)28-16(27-10-25)26-9-11-6-12(17(19,20)21)8-13(7-11)18(22,23)24/h2-8H,9H2,1H3,(H2,26,27,28)