(3S)-3-methyl-N-(2-methyl-6-propan-2-yl-phenyl)-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: (3S)-3-methyl-N-(2-methyl-6-propan-2-yl-phenyl)-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: (3S)-N-(2-isopropyl-6-methyl-phenyl)-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-3-methyl-N-(2-methyl-6-propan-2-ylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-3-methyl-N-(2-methyl-6-propan-2-ylphenyl)-1-oxo-4H-isochromene-3-carboxamide Traditional Name: (3S)-N-(2-isopropyl-6-methyl-phenyl)-1-keto-3-methyl-isochroman-3-carboxamide Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)[C@@]2(CC3=CC=CC=C3C(=O)O2)C

InChI

InChI=1S/C21H23NO3/c1-13(2)16-11-7-8-14(3)18(16)22-20(24)21(4)12-15-9-5-6-10-17(15)19(23)25-21/h5-11,13H,12H2,1-4H3,(H,22,24)/t21-/m0/s1