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

Systemtic Name: methyl 4-(3-bromanyl-5-ethoxy-4-prop-2-ynoxy-phenyl)-2-methyl-5-oxidanylidene-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Openeye Name: methyl 4-(3-bromo-5-ethoxy-4-prop-2-ynoxy-phenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate CAS Name: 4-(3-bromo-5-ethoxy-4-prop-2-ynoxyphenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-bromo-5-ethoxy-4-prop-2-ynoxyphenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Traditional Name: 4-(3-bromo-5-ethoxy-4-propargyloxy-phenyl)-5-keto-2-methyl-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid methyl ester Formula: C26H22BrNO5 MolecularWeight: 508.36058

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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#C

Isomeric SMILES

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

InChI

InChI=1S/C26H22BrNO5/c1-5-11-33-25-18(27)12-15(13-19(25)32-6-2)21-20(26(30)31-4)14(3)28-23-16-9-7-8-10-17(16)24(29)22(21)23/h1,7-10,12-13,21,28H,6,11H2,2-4H3