ethyl (4R)-4-(5-bromanyl-2-ethoxy-phenyl)-2-methyl-5-oxidanylidene-4,4a-dihydroindeno[1,2-b]pyridine-3-carboxylate

Systemtic Name: ethyl (4R)-4-(5-bromanyl-2-ethoxy-phenyl)-2-methyl-5-oxidanylidene-4,4a-dihydroindeno[1,2-b]pyridine-3-carboxylate Openeye Name: ethyl (4R)-4-(5-bromo-2-ethoxy-phenyl)-2-methyl-5-oxo-4,4a-dihydroindeno[1,2-b]pyridine-3-carboxylate CAS Name: (4R)-4-(5-bromo-2-ethoxyphenyl)-2-methyl-5-oxo-4,4a-dihydroindeno[1,2-b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-4-(5-bromo-2-ethoxyphenyl)-2-methyl-5-oxo-4,4a-dihydroindeno[1,2-b]pyridine-3-carboxylate Traditional Name: (4R)-4-(5-bromo-2-ethoxy-phenyl)-5-keto-2-methyl-4,4a-dihydroindeno[1,2-b]pyridine-3-carboxylic acid ethyl ester Formula: C24H22BrNO4 MolecularWeight: 468.33978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C2C3C(=NC(=C2C(=O)OCC)C)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)[C@H]2C3C(=NC(=C2C(=O)OCC)C)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H22BrNO4/c1-4-29-18-11-10-14(25)12-17(18)20-19(24(28)30-5-2)13(3)26-22-15-8-6-7-9-16(15)23(27)21(20)22/h6-12,20-21H,4-5H2,1-3H3/t20-,21?/m1/s1