N-[[2-(dimethylamino)pyridin-1-ium-4-yl]methyl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-1-ium-4-yl]methyl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[[2-(dimethylamino)pyridin-1-ium-4-yl]methyl]-2-oxo-chromene-3-carboxamide CAS Name: N-[[2-(dimethylamino)-4-pyridin-1-iumyl]methyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[[2-(dimethylamino)pyridin-1-ium-4-yl]methyl]-2-oxochromene-3-carboxamide Traditional Name: N-[[2-(dimethylamino)pyridin-1-ium-4-yl]methyl]-2-keto-chromene-3-carboxamide Formula: C18H18N3O3+ MolecularWeight: 324.35382

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=[NH+]C=CC(=C1)CNC(=O)C2=CC3=CC=CC=C3OC2=O

Isomeric SMILES

CN(C)C1=[NH+]C=CC(=C1)CNC(=O)C2=CC3=CC=CC=C3OC2=O

InChI

InChI=1S/C18H17N3O3/c1-21(2)16-9-12(7-8-19-16)11-20-17(22)14-10-13-5-3-4-6-15(13)24-18(14)23/h3-10H,11H2,1-2H3,(H,20,22)/p+1