[3-[[6-[(4-fluorophenyl)methylamino]pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[6-[(4-fluorophenyl)methylamino]pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[[6-[(4-fluorophenyl)methylamino]-3-pyridyl]amino]-3-oxo-propyl]ammonium CAS Name: [3-[[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]amino]-3-oxopropyl]ammonium IUPAC Name: [3-[[6-[(4-fluorophenyl)methylamino]pyridin-3-yl]amino]-3-oxopropyl]azanium Traditional Name: [3-[[6-[(4-fluorobenzyl)amino]-3-pyridyl]amino]-3-keto-propyl]ammonium Formula: C15H18FN4O+ MolecularWeight: 289.328023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NC=C(C=C2)NC(=O)CC[NH3+])F

Isomeric SMILES

C1=CC(=CC=C1CNC2=NC=C(C=C2)NC(=O)CC[NH3+])F

InChI

InChI=1S/C15H17FN4O/c16-12-3-1-11(2-4-12)9-18-14-6-5-13(10-19-14)20-15(21)7-8-17/h1-6,10H,7-9,17H2,(H,18,19)(H,20,21)/p+1