N-(2-hydroxyethyl)-1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-carboxamide

Systemtic Name: N-(2-hydroxyethyl)-1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-carboxamide Openeye Name: N-(2-hydroxyethyl)-1-[2-(4-methoxyphenyl)-2-oxo-ethyl]pyridin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyethyl)-1-[2-(4-methoxyphenyl)-2-oxoethyl]-4-pyridin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyethyl)-1-[2-(4-methoxyphenyl)-2-oxoethyl]pyridin-1-ium-4-carboxamide Traditional Name: N-(2-hydroxyethyl)-1-[2-keto-2-(4-methoxyphenyl)ethyl]pyridin-1-ium-4-carboxamide Formula: C17H19N2O4+ MolecularWeight: 315.34376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C(=O)NCCO

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C(=O)NCCO

InChI

InChI=1S/C17H18N2O4/c1-23-15-4-2-13(3-5-15)16(21)12-19-9-6-14(7-10-19)17(22)18-8-11-20/h2-7,9-10,20H,8,11-12H2,1H3/p+1