(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C22H16BrNO6 MolecularWeight: 470.26954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

InChI

InChI=1S/C22H16BrNO6/c1-11-17-8-14(23)3-6-18(17)30-21(11)22(27)28-10-13-7-20(26)29-19-9-15(24-12(2)25)4-5-16(13)19/h3-9H,10H2,1-2H3,(H,24,25)