3-[(4-azanyl-2-fluoranyl-phenyl)amino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[(4-azanyl-2-fluoranyl-phenyl)amino]propyl-methyl-(phenylmethyl)azanium Openeye Name: 3-(4-amino-2-fluoro-anilino)propyl-benzyl-methyl-ammonium CAS Name: 3-(4-amino-2-fluoroanilino)propyl-methyl-(phenylmethyl)ammonium IUPAC Name: 3-(4-amino-2-fluoroanilino)propyl-benzyl-methylazanium Traditional Name: 3-(4-amino-2-fluoro-anilino)propyl-benzyl-methyl-ammonium Formula: C17H23FN3+ MolecularWeight: 288.383023

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC1=C(C=C(C=C1)N)F)CC2=CC=CC=C2

Isomeric SMILES

C[NH+](CCCNC1=C(C=C(C=C1)N)F)CC2=CC=CC=C2

InChI

InChI=1S/C17H22FN3/c1-21(13-14-6-3-2-4-7-14)11-5-10-20-17-9-8-15(19)12-16(17)18/h2-4,6-9,12,20H,5,10-11,13,19H2,1H3/p+1