3-[(2-fluorophenyl)carbonyl-(pyridin-3-ylmethyl)amino]propylazanium

Systemtic Name: 3-[(2-fluorophenyl)carbonyl-(pyridin-3-ylmethyl)amino]propylazanium Openeye Name: 3-[(2-fluorobenzoyl)-(3-pyridylmethyl)amino]propylammonium CAS Name: 3-[[(2-fluorophenyl)-oxomethyl]-(3-pyridinylmethyl)amino]propylammonium IUPAC Name: 3-[(2-fluorobenzoyl)-(pyridin-3-ylmethyl)amino]propylazanium Traditional Name: 3-[(2-fluorobenzoyl)-(3-pyridylmethyl)amino]propylammonium Formula: C16H19FN3O+ MolecularWeight: 288.339963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N(CCC[NH3+])CC2=CN=CC=C2)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N(CCC[NH3+])CC2=CN=CC=C2)F

InChI

InChI=1S/C16H18FN3O/c17-15-7-2-1-6-14(15)16(21)20(10-4-8-18)12-13-5-3-9-19-11-13/h1-3,5-7,9,11H,4,8,10,12,18H2/p+1