2-(4-tert-butylphenyl)-N-[(2-chlorophenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-tert-butylphenyl)-N-[(2-chlorophenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(4-tert-butylphenyl)-N-[(2-chlorophenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(4-tert-butylphenyl)-N-[(2-chlorophenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-tert-butylphenyl)-N-[(2-chlorophenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(4-tert-butylphenyl)-N-(2-chlorobenzyl)cinchoninamide Formula: C27H25ClN2O MolecularWeight: 428.9532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C27H25ClN2O/c1-27(2,3)20-14-12-18(13-15-20)25-16-22(21-9-5-7-11-24(21)30-25)26(31)29-17-19-8-4-6-10-23(19)28/h4-16H,17H2,1-3H3,(H,29,31)