3-[(4-fluorophenyl)-[(3-methoxyphenyl)methyl]amino]propylazanium

Systemtic Name: 3-[(4-fluorophenyl)-[(3-methoxyphenyl)methyl]amino]propylazanium Openeye Name: 3-[4-fluoro-N-[(3-methoxyphenyl)methyl]anilino]propylammonium CAS Name: 3-[4-fluoro-N-[(3-methoxyphenyl)methyl]anilino]propylammonium IUPAC Name: 3-[4-fluoro-N-[(3-methoxyphenyl)methyl]anilino]propylazanium Traditional Name: 3-(4-fluoro-N-m-anisyl-anilino)propylammonium Formula: C17H22FN2O+ MolecularWeight: 289.367783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CCC[NH3+])C2=CC=C(C=C2)F

Isomeric SMILES

COC1=CC=CC(=C1)CN(CCC[NH3+])C2=CC=C(C=C2)F

InChI

InChI=1S/C17H21FN2O/c1-21-17-5-2-4-14(12-17)13-20(11-3-10-19)16-8-6-15(18)7-9-16/h2,4-9,12H,3,10-11,13,19H2,1H3/p+1