(3S)-N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: (3S)-N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: (3S)-N-[(1S)-1-(benzofuran-2-yl)ethyl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-[(1S)-1-(2-benzofuranyl)ethyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: (3S)-N-[(1S)-1-(benzofuran-2-yl)ethyl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C

Isomeric SMILES

C[C@@H](C1=CC2=CC=CC=C2O1)NC(=O)[C@@]3(CC4=CC=CC=C4C(=O)O3)C

InChI

InChI=1S/C21H19NO4/c1-13(18-11-14-7-4-6-10-17(14)25-18)22-20(24)21(2)12-15-8-3-5-9-16(15)19(23)26-21/h3-11,13H,12H2,1-2H3,(H,22,24)/t13-,21-/m0/s1