(3,3-dimethyl-2-oxidanylidene-butyl) 2-(4-methoxyphenyl)-3,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-(4-methoxyphenyl)-3,8-dimethyl-quinoline-4-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-(4-methoxyphenyl)-3,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-3,8-dimethyl-4-quinolinecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-(4-methoxyphenyl)-3,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)-3,8-dimethyl-cinchoninic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C(=C(N=C12)C3=CC=C(C=C3)OC)C)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC=CC2=C(C(=C(N=C12)C3=CC=C(C=C3)OC)C)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C25H27NO4/c1-15-8-7-9-19-21(24(28)30-14-20(27)25(3,4)5)16(2)23(26-22(15)19)17-10-12-18(29-6)13-11-17/h7-13H,14H2,1-6H3