[1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-3,7,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 6-bromanyl-3,7,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-methoxyphenyl)-1-methyl-2-oxo-ethyl] 6-bromo-3,7,8-trimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 6-bromo-3,7,8-trimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [1-(4-methoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methoxyphenyl)-1-oxopropan-2-yl] 6-bromo-3,7,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-3,7,8-trimethyl-2-(p-tolyl)cinchoninic acid [2-keto-2-(4-methoxyphenyl)-1-methyl-ethyl] ester Formula: C30H28BrNO4 MolecularWeight: 546.45162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C(=C(C=C3C(=C2C)C(=O)OC(C)C(=O)C4=CC=C(C=C4)OC)Br)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C(=C(C=C3C(=C2C)C(=O)OC(C)C(=O)C4=CC=C(C=C4)OC)Br)C)C

InChI

InChI=1S/C30H28BrNO4/c1-16-7-9-21(10-8-16)27-19(4)26(24-15-25(31)17(2)18(3)28(24)32-27)30(34)36-20(5)29(33)22-11-13-23(35-6)14-12-22/h7-15,20H,1-6H3