N-methyl-1-[2-(prop-2-enylcarbamoylamino)pyridin-4-yl]oxy-indol-1-ium-1-carboxamide

Systemtic Name: N-methyl-1-[2-(prop-2-enylcarbamoylamino)pyridin-4-yl]oxy-indol-1-ium-1-carboxamide Openeye Name: 1-[[2-(allylcarbamoylamino)-4-pyridyl]oxy]-N-methyl-indol-1-ium-1-carboxamide CAS Name: N-methyl-1-[[2-[[oxo-(prop-2-enylamino)methyl]amino]-4-pyridinyl]oxy]-1-indol-1-iumcarboxamide IUPAC Name: N-methyl-1-[2-(prop-2-enylcarbamoylamino)pyridin-4-yl]oxyindol-1-ium-1-carboxamide Traditional Name: 1-[[2-(allylcarbamoylamino)-4-pyridyl]oxy]-N-methyl-indol-1-ium-1-carboxamide Formula: C19H20N5O3+ MolecularWeight: 366.3938

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)[N+]1(C=CC2=CC=CC=C21)OC3=CC(=NC=C3)NC(=O)NCC=C

Isomeric SMILES

CNC(=O)[N+]1(C=CC2=CC=CC=C21)OC3=CC(=NC=C3)NC(=O)NCC=C

InChI

InChI=1S/C19H19N5O3/c1-3-10-22-18(25)23-17-13-15(8-11-21-17)27-24(19(26)20-2)12-9-14-6-4-5-7-16(14)24/h3-9,11-13H,1,10H2,2H3,(H2-,20,21,22,23,25,26)/p+1