6-bromanyl-2-(4-tert-butylphenyl)-N-[(4-methoxyphenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-tert-butylphenyl)-N-[(4-methoxyphenyl)methyl]quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-tert-butylphenyl)-N-[(4-methoxyphenyl)methyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-tert-butylphenyl)-N-[(4-methoxyphenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-tert-butylphenyl)-N-[(4-methoxyphenyl)methyl]quinoline-4-carboxamide Traditional Name: 6-bromo-2-(4-tert-butylphenyl)-N-p-anisyl-cinchoninamide Formula: C28H27BrN2O2 MolecularWeight: 503.43018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC4=CC=C(C=C4)OC

InChI

InChI=1S/C28H27BrN2O2/c1-28(2,3)20-9-7-19(8-10-20)26-16-24(23-15-21(29)11-14-25(23)31-26)27(32)30-17-18-5-12-22(33-4)13-6-18/h5-16H,17H2,1-4H3,(H,30,32)