N-[[2-(2-methoxyphenoxy)pyridin-3-yl]methyl]-2-(methylamino)pyridin-1-ium-4-carboxamide

Systemtic Name: N-[[2-(2-methoxyphenoxy)pyridin-3-yl]methyl]-2-(methylamino)pyridin-1-ium-4-carboxamide Openeye Name: N-[[2-(2-methoxyphenoxy)-3-pyridyl]methyl]-2-(methylamino)pyridin-1-ium-4-carboxamide CAS Name: N-[[2-(2-methoxyphenoxy)-3-pyridinyl]methyl]-2-(methylamino)-4-pyridin-1-iumcarboxamide IUPAC Name: N-[[2-(2-methoxyphenoxy)pyridin-3-yl]methyl]-2-(methylamino)pyridin-1-ium-4-carboxamide Traditional Name: N-[[2-(2-methoxyphenoxy)-3-pyridyl]methyl]-2-(methylamino)pyridin-1-ium-4-carboxamide Formula: C20H21N4O3+ MolecularWeight: 365.40574

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=[NH+]C=CC(=C1)C(=O)NCC2=C(N=CC=C2)OC3=CC=CC=C3OC

Isomeric SMILES

CNC1=[NH+]C=CC(=C1)C(=O)NCC2=C(N=CC=C2)OC3=CC=CC=C3OC

InChI

InChI=1S/C20H20N4O3/c1-21-18-12-14(9-11-22-18)19(25)24-13-15-6-5-10-23-20(15)27-17-8-4-3-7-16(17)26-2/h3-12H,13H2,1-2H3,(H,21,22)(H,24,25)/p+1