carbamimidoyl-(3-ethylphenyl)-[2-fluoranyl-5-(trifluoromethyl)phenyl]-methyl-azanium

Systemtic Name: carbamimidoyl-(3-ethylphenyl)-[2-fluoranyl-5-(trifluoromethyl)phenyl]-methyl-azanium Openeye Name: carbamimidoyl-(3-ethylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]-methyl-ammonium CAS Name: carbamimidoyl-(3-ethylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]-methylammonium IUPAC Name: carbamimidoyl-(3-ethylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]-methylazanium Traditional Name: amidino-(3-ethylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]-methyl-ammonium Formula: C17H18F4N3+ MolecularWeight: 340.338533

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)[N+](C)(C2=C(C=CC(=C2)C(F)(F)F)F)C(=N)N

Isomeric SMILES

CCC1=CC(=CC=C1)[N+](C)(C2=C(C=CC(=C2)C(F)(F)F)F)C(=N)N

InChI

InChI=1S/C17H18F4N3/c1-3-11-5-4-6-13(9-11)24(2,16(22)23)15-10-12(17(19,20)21)7-8-14(15)18/h4-10H,3H2,1-2H3,(H3,22,23)/q+1