N-(4-acetamidophenyl)-6-bromanyl-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-6-bromanyl-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: N-(4-acetamidophenyl)-6-bromo-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-(4-acetamidophenyl)-6-bromo-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(4-acetamidophenyl)-6-bromo-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: N-(4-acetamidophenyl)-6-bromo-1-keto-3-methyl-isochroman-3-carboxamide Formula: C19H17BrN2O4 MolecularWeight: 417.25328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2(CC3=C(C=CC(=C3)Br)C(=O)O2)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2(CC3=C(C=CC(=C3)Br)C(=O)O2)C

InChI

InChI=1S/C19H17BrN2O4/c1-11(23)21-14-4-6-15(7-5-14)22-18(25)19(2)10-12-9-13(20)3-8-16(12)17(24)26-19/h3-9H,10H2,1-2H3,(H,21,23)(H,22,25)