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

Systemtic Name: [4-[[6-[(4-fluorophenyl)methylamino]pyridin-3-yl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[[6-[(4-fluorophenyl)methylamino]-3-pyridyl]amino]-4-oxo-butyl]ammonium CAS Name: [4-[[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]amino]-4-oxobutyl]ammonium IUPAC Name: [4-[[6-[(4-fluorophenyl)methylamino]pyridin-3-yl]amino]-4-oxobutyl]azanium Traditional Name: [4-[[6-[(4-fluorobenzyl)amino]-3-pyridyl]amino]-4-keto-butyl]ammonium Formula: C16H20FN4O+ MolecularWeight: 303.354603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19FN4O/c17-13-5-3-12(4-6-13)10-19-15-8-7-14(11-20-15)21-16(22)2-1-9-18/h3-8,11H,1-2,9-10,18H2,(H,19,20)(H,21,22)/p+1