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

Systemtic Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-(4-chlorophenyl)quinoline-4-carboxamide Openeye Name: N-[(E)-(4-tert-butylphenyl)methyleneamino]-2-(4-chlorophenyl)quinoline-4-carboxamide CAS Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-(4-chlorophenyl)-4-quinolinecarboxamide IUPAC Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-(4-chlorophenyl)quinoline-4-carboxamide Traditional Name: N-[(E)-(4-tert-butylbenzylidene)amino]-2-(4-chlorophenyl)cinchoninamide Formula: C27H24ClN3O MolecularWeight: 441.95196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H24ClN3O/c1-27(2,3)20-12-8-18(9-13-20)17-29-31-26(32)23-16-25(19-10-14-21(28)15-11-19)30-24-7-5-4-6-22(23)24/h4-17H,1-3H3,(H,31,32)/b29-17+