[4-[azaniumylidene(azanyl)methyl]-2-fluoranyl-phenyl]methyl-ethyl-(phenylmethyl)azanium

Systemtic Name: [4-[azaniumylidene(azanyl)methyl]-2-fluoranyl-phenyl]methyl-ethyl-(phenylmethyl)azanium Openeye Name: [4-[amino(azaniumylidene)methyl]-2-fluoro-phenyl]methyl-benzyl-ethyl-ammonium CAS Name: [4-[amino(iminio)methyl]-2-fluorophenyl]methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: [4-[amino(azaniumylidene)methyl]-2-fluorophenyl]methyl-benzyl-ethylazanium Traditional Name: [4-[amino(iminio)methyl]-2-fluoro-benzyl]-benzyl-ethyl-ammonium Formula: C17H22FN3+2 MolecularWeight: 287.375083

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC2=C(C=C(C=C2)C(=[NH2+])N)F

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC2=C(C=C(C=C2)C(=[NH2+])N)F

InChI

InChI=1S/C17H20FN3/c1-2-21(11-13-6-4-3-5-7-13)12-15-9-8-14(17(19)20)10-16(15)18/h3-10H,2,11-12H2,1H3,(H3,19,20)/p+2