N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: N-[4-[2,4-bis(1,1-dimethylpropoxy)phenyl]butyl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: N-[4-(2,4-ditert-amyloxyphenyl)butyl]-2-(p-tolyl)cinchoninamide Formula: C37H46N2O3 MolecularWeight: 566.77274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C)OC(C)(C)CC

Isomeric SMILES

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C)OC(C)(C)CC

InChI

InChI=1S/C37H46N2O3/c1-8-36(4,5)41-29-22-21-28(34(24-29)42-37(6,7)9-2)14-12-13-23-38-35(40)31-25-33(27-19-17-26(3)18-20-27)39-32-16-11-10-15-30(31)32/h10-11,15-22,24-25H,8-9,12-14,23H2,1-7H3,(H,38,40)