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

Systemtic Name: [1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 3,7,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-methoxyphenyl)-1-methyl-2-oxo-ethyl] 2-(4-benzyloxyphenyl)-3,7,8-trimethyl-quinoline-4-carboxylate CAS Name: 3,7,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [1-(4-methoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methoxyphenyl)-1-oxopropan-2-yl] 3,7,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-3,7,8-trimethyl-cinchoninic acid [2-keto-2-(4-methoxyphenyl)-1-methyl-ethyl] ester Formula: C36H33NO5 MolecularWeight: 559.65092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)OC(C)C(=O)C3=CC=C(C=C3)OC)C)C4=CC=C(C=C4)OCC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)OC(C)C(=O)C3=CC=C(C=C3)OC)C)C4=CC=C(C=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C36H33NO5/c1-22-11-20-31-32(36(39)42-25(4)35(38)28-14-16-29(40-5)17-15-28)24(3)33(37-34(31)23(22)2)27-12-18-30(19-13-27)41-21-26-9-7-6-8-10-26/h6-20,25H,21H2,1-5H3