[3-[4-(2-oxidanylidenepyridin-1-yl)butanoylamino]phenyl]methylazanium

Systemtic Name: [3-[4-(2-oxidanylidenepyridin-1-yl)butanoylamino]phenyl]methylazanium Openeye Name: [3-[4-(2-oxo-1-pyridyl)butanoylamino]phenyl]methylammonium CAS Name: [3-[[1-oxo-4-(2-oxo-1-pyridinyl)butyl]amino]phenyl]methylammonium IUPAC Name: [3-[4-(2-oxopyridin-1-yl)butanoylamino]phenyl]methylazanium Traditional Name: [3-[4-(2-keto-1-pyridyl)butanoylamino]benzyl]ammonium Formula: C16H20N3O2+ MolecularWeight: 286.3489

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)N(C=C1)CCCC(=O)NC2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

C1=CC(=O)N(C=C1)CCCC(=O)NC2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C16H19N3O2/c17-12-13-5-3-6-14(11-13)18-15(20)7-4-10-19-9-2-1-8-16(19)21/h1-3,5-6,8-9,11H,4,7,10,12,17H2,(H,18,20)/p+1