(3S)-3-methyl-1-oxidanylidene-N-(2,4,6-trimethylphenyl)-4H-isochromene-3-carboxamide

Systemtic Name: (3S)-3-methyl-1-oxidanylidene-N-(2,4,6-trimethylphenyl)-4H-isochromene-3-carboxamide Openeye Name: (3S)-3-methyl-1-oxo-N-(2,4,6-trimethylphenyl)isochromane-3-carboxamide CAS Name: (3S)-3-methyl-1-oxo-N-(2,4,6-trimethylphenyl)-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-3-methyl-1-oxo-N-(2,4,6-trimethylphenyl)-4H-isochromene-3-carboxamide Traditional Name: (3S)-1-keto-N-mesityl-3-methyl-isochroman-3-carboxamide Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO3/c1-12-9-13(2)17(14(3)10-12)21-19(23)20(4)11-15-7-5-6-8-16(15)18(22)24-20/h5-10H,11H2,1-4H3,(H,21,23)/t20-/m0/s1