(4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C26H31NO2 MolecularWeight: 389.52984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=C(C=C(C=C3C)C(C)(C)C)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=C(C=C(C=C3C)C(C)(C)C)C

InChI

InChI=1S/C26H31NO2/c1-8-22-18(4)24(20-11-9-10-12-23(20)27-22)25(28)29-15-21-16(2)13-19(14-17(21)3)26(5,6)7/h9-14H,8,15H2,1-7H3