[1-(4-methoxyphenyl)carbonyl-2,2,4-trimethyl-quinolin-6-yl] benzoate

Systemtic Name: [1-(4-methoxyphenyl)carbonyl-2,2,4-trimethyl-quinolin-6-yl] benzoate Openeye Name: [1-(4-methoxybenzoyl)-2,2,4-trimethyl-6-quinolyl] benzoate CAS Name: benzoic acid [1-[(4-methoxyphenyl)-oxomethyl]-2,2,4-trimethyl-6-quinolinyl] ester IUPAC Name: [1-(4-methoxybenzoyl)-2,2,4-trimethylquinolin-6-yl] benzoate Traditional Name: benzoic acid (2,2,4-trimethyl-1-p-anisoyl-6-quinolyl) ester Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)OC)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)OC)(C)C

InChI

InChI=1S/C27H25NO4/c1-18-17-27(2,3)28(25(29)19-10-12-21(31-4)13-11-19)24-15-14-22(16-23(18)24)32-26(30)20-8-6-5-7-9-20/h5-17H,1-4H3