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

Systemtic Name: methyl 4-(3-bromanyl-4,5-diethoxy-phenyl)-2-methyl-5-oxidanylidene-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Openeye Name: methyl 4-(3-bromo-4,5-diethoxy-phenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate CAS Name: 4-(3-bromo-4,5-diethoxyphenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-bromo-4,5-diethoxyphenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Traditional Name: 4-(3-bromo-4,5-diethoxy-phenyl)-5-keto-2-methyl-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid methyl ester Formula: C25H24BrNO5 MolecularWeight: 498.36576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C3=C(C4=CC=CC=C4C3=O)NC(=C2C(=O)OC)C)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C3=C(C4=CC=CC=C4C3=O)NC(=C2C(=O)OC)C)Br)OCC

InChI

InChI=1S/C25H24BrNO5/c1-5-31-18-12-14(11-17(26)24(18)32-6-2)20-19(25(29)30-4)13(3)27-22-15-9-7-8-10-16(15)23(28)21(20)22/h7-12,20,27H,5-6H2,1-4H3