6-bromanyl-2-(4-tert-butylphenyl)-N-(phenylmethyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-tert-butylphenyl)-N-(phenylmethyl)quinoline-4-carboxamide Openeye Name: N-benzyl-6-bromo-2-(4-tert-butylphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-tert-butylphenyl)-N-(phenylmethyl)-4-quinolinecarboxamide IUPAC Name: N-benzyl-6-bromo-2-(4-tert-butylphenyl)quinoline-4-carboxamide Traditional Name: N-benzyl-6-bromo-2-(4-tert-butylphenyl)cinchoninamide Formula: C27H25BrN2O MolecularWeight: 473.4042

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C27H25BrN2O/c1-27(2,3)20-11-9-19(10-12-20)25-16-23(22-15-21(28)13-14-24(22)30-25)26(31)29-17-18-7-5-4-6-8-18/h4-16H,17H2,1-3H3,(H,29,31)