(3R)-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-N-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]-1-keto-isochroman-3-carboxamide Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CNC(=O)[C@H]3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C22H23NO5/c1-3-26-18-10-15-8-13(2)27-19(15)11-16(18)12-23-21(24)20-9-14-6-4-5-7-17(14)22(25)28-20/h4-7,10-11,13,20H,3,8-9,12H2,1-2H3,(H,23,24)/t13-,20+/m0/s1