(3R)-N-[4-(diethylcarbamoyl)phenyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: (3R)-N-[4-(diethylcarbamoyl)phenyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: (3R)-N-[4-(diethylcarbamoyl)phenyl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-N-[4-[diethylamino(oxo)methyl]phenyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[4-(diethylcarbamoyl)phenyl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: (3R)-N-[4-(diethylcarbamoyl)phenyl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O4/c1-4-24(5-2)19(25)15-10-12-17(13-11-15)23-21(27)22(3)14-16-8-6-7-9-18(16)20(26)28-22/h6-13H,4-5,14H2,1-3H3,(H,23,27)/t22-/m1/s1