(4-tert-butylphenyl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: (4-tert-butylphenyl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: (4-tert-butylphenyl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid (4-tert-butylbenzyl) ester Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C24H27NO2/c1-6-20-16(2)22(19-9-7-8-10-21(19)25-20)23(26)27-15-17-11-13-18(14-12-17)24(3,4)5/h7-14H,6,15H2,1-5H3