methyl 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate

Systemtic Name: methyl 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Openeye Name: methyl 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate CAS Name: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Traditional Name: 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-5-keto-2-methyl-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid methyl ester Formula: C22H18BrNO5 MolecularWeight: 456.28602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Br)O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Br)O)OC)C(=O)OC

InChI

InChI=1S/C22H18BrNO5/c1-10-16(22(27)29-3)17(11-8-14(23)21(26)15(9-11)28-2)18-19(24-10)12-6-4-5-7-13(12)20(18)25/h4-9,17,24,26H,1-3H3