N-[4-(2-oxidanyl-3-pyridin-1-ium-1-yl-propoxy)phenyl]ethanamide

Systemtic Name: N-[4-(2-oxidanyl-3-pyridin-1-ium-1-yl-propoxy)phenyl]ethanamide Openeye Name: N-[4-(2-hydroxy-3-pyridin-1-ium-1-yl-propoxy)phenyl]acetamide CAS Name: N-[4-[2-hydroxy-3-(1-pyridin-1-iumyl)propoxy]phenyl]acetamide IUPAC Name: N-[4-(2-hydroxy-3-pyridin-1-ium-1-ylpropoxy)phenyl]acetamide Traditional Name: N-[4-(2-hydroxy-3-pyridin-1-ium-1-yl-propoxy)phenyl]acetamide Formula: C16H19N2O3+ MolecularWeight: 287.33366

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OCC(C[N+]2=CC=CC=C2)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OCC(C[N+]2=CC=CC=C2)O

InChI

InChI=1S/C16H18N2O3/c1-13(19)17-14-5-7-16(8-6-14)21-12-15(20)11-18-9-3-2-4-10-18/h2-10,15,20H,11-12H2,1H3/p+1