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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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