N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[1-[(2,6-dimethylanilino)-oxomethyl]cyclohexyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-2-phenyl-cinchoninamide Formula: C31H31N3O2 MolecularWeight: 477.59674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2(CCCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2(CCCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C31H31N3O2/c1-21-12-11-13-22(2)28(21)33-30(36)31(18-9-4-10-19-31)34-29(35)25-20-27(23-14-5-3-6-15-23)32-26-17-8-7-16-24(25)26/h3,5-8,11-17,20H,4,9-10,18-19H2,1-2H3,(H,33,36)(H,34,35)