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

Systemtic Name: [2-[4-(2-oxidanylidenepyridin-1-yl)butanoylamino]phenyl]methylazanium Openeye Name: [2-[4-(2-oxo-1-pyridyl)butanoylamino]phenyl]methylammonium CAS Name: [2-[[1-oxo-4-(2-oxo-1-pyridinyl)butyl]amino]phenyl]methylammonium IUPAC Name: [2-[4-(2-oxopyridin-1-yl)butanoylamino]phenyl]methylazanium Traditional Name: [2-[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=C(C(=C1)C[NH3+])NC(=O)CCCN2C=CC=CC2=O

Isomeric SMILES

C1=CC=C(C(=C1)C[NH3+])NC(=O)CCCN2C=CC=CC2=O

InChI

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