(3S)-N-(4-methylpyridin-2-yl)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: (3S)-N-(4-methylpyridin-2-yl)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3S)-N-(4-methyl-2-pyridyl)-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: (3S)-N-(4-methyl-2-pyridinyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3S)-N-(4-methylpyridin-2-yl)-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3S)-1-keto-N-(4-methyl-2-pyridyl)-3-phenyl-isochroman-6-carboxamide Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)O[C@@H](C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O3/c1-14-9-10-23-20(11-14)24-21(25)16-7-8-18-17(12-16)13-19(27-22(18)26)15-5-3-2-4-6-15/h2-12,19H,13H2,1H3,(H,23,24,25)/t19-/m0/s1