[6-(2-methoxy-4-oxidanyl-phenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methyl 5-bromanylthiophene-2-carboxylate

Systemtic Name: [6-(2-methoxy-4-oxidanyl-phenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methyl 5-bromanylthiophene-2-carboxylate Openeye Name: [6-(4-hydroxy-2-methoxy-phenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methyl 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid [6-(4-hydroxy-2-methoxyphenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methyl ester IUPAC Name: [6-(4-hydroxy-2-methoxyphenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methyl 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid [6-(4-hydroxy-2-methoxy-phenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methyl ester Formula: C25H24BrNO4S MolecularWeight: 514.43136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC2=C1C(=C(C=C2)C3=C(C=C(C=C3)O)OC)COC(=O)C4=CC=C(S4)Br)(C)C

Isomeric SMILES

CC1=CC(NC2=C1C(=C(C=C2)C3=C(C=C(C=C3)O)OC)COC(=O)C4=CC=C(S4)Br)(C)C

InChI

InChI=1S/C25H24BrNO4S/c1-14-12-25(2,3)27-19-8-7-16(17-6-5-15(28)11-20(17)30-4)18(23(14)19)13-31-24(29)21-9-10-22(26)32-21/h5-12,27-28H,13H2,1-4H3