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

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3-methyl-2-phenyl-4-quinolinecarboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 3-methyl-2-phenyl-cinchoninic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C30H31NO2 MolecularWeight: 437.57264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C)C)C(C)(C)C

InChI

InChI=1S/C30H31NO2/c1-19-16-23(30(4,5)6)17-20(2)25(19)18-33-29(32)27-21(3)28(22-12-8-7-9-13-22)31-26-15-11-10-14-24(26)27/h7-17H,18H2,1-6H3