[4-[azaniumylidene(azanyl)methyl]-2-fluoranyl-phenyl]methyl-methyl-propan-2-yl-azanium

Systemtic Name: [4-[azaniumylidene(azanyl)methyl]-2-fluoranyl-phenyl]methyl-methyl-propan-2-yl-azanium Openeye Name: [4-[amino(azaniumylidene)methyl]-2-fluoro-phenyl]methyl-isopropyl-methyl-ammonium CAS Name: [4-[amino(iminio)methyl]-2-fluorophenyl]methyl-methyl-propan-2-ylammonium IUPAC Name: [4-[amino(azaniumylidene)methyl]-2-fluorophenyl]methyl-methyl-propan-2-ylazanium Traditional Name: [4-[amino(iminio)methyl]-2-fluoro-benzyl]-isopropyl-methyl-ammonium Formula: C12H20FN3+2 MolecularWeight: 225.305703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18FN3/c1-8(2)16(3)7-10-5-4-9(12(14)15)6-11(10)13/h4-6,8H,7H2,1-3H3,(H3,14,15)/p+2