[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 6-bromanyl-3,7,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 6-bromanyl-3,7,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 2-(4-benzyloxyphenyl)-6-bromo-3,7,8-trimethyl-quinoline-4-carboxylate CAS Name: 6-bromo-3,7,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 6-bromo-3,7,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-6-bromo-3,7,8-trimethyl-cinchoninic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C35H30BrNO5 MolecularWeight: 624.5204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C(C(=NC2=C1C)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)OCC(=O)C5=CC=C(C=C5)OC)Br

Isomeric SMILES

CC1=C(C=C2C(=C(C(=NC2=C1C)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)OCC(=O)C5=CC=C(C=C5)OC)Br

InChI

InChI=1S/C35H30BrNO5/c1-21-22(2)34-29(18-30(21)36)32(35(39)42-20-31(38)25-10-14-27(40-4)15-11-25)23(3)33(37-34)26-12-16-28(17-13-26)41-19-24-8-6-5-7-9-24/h5-18H,19-20H2,1-4H3