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

Systemtic Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-1-oxo-isochromane-3-carboxamide CAS Name: N-[[2-(dimethylamino)-3-pyridinyl]methyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-1-keto-isochroman-3-carboxamide Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=N1)CNC(=O)C2CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CN(C)C1=C(C=CC=N1)CNC(=O)C2CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C18H19N3O3/c1-21(2)16-13(7-5-9-19-16)11-20-17(22)15-10-12-6-3-4-8-14(12)18(23)24-15/h3-9,15H,10-11H2,1-2H3,(H,20,22)