N-(1-adamantyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide

Systemtic Name: N-(1-adamantyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Openeye Name: N-(1-adamantyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide CAS Name: N-(1-adamantyl)-2-(3,4-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(1-adamantyl)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-(1-adamantyl)-2-(3,4-dimethylphenyl)cinchoninamide Formula: C28H30N2O MolecularWeight: 410.5506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC45CC6CC(C4)CC(C6)C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC45CC6CC(C4)CC(C6)C5)C

InChI

InChI=1S/C28H30N2O/c1-17-7-8-22(9-18(17)2)26-13-24(23-5-3-4-6-25(23)29-26)27(31)30-28-14-19-10-20(15-28)12-21(11-19)16-28/h3-9,13,19-21H,10-12,14-16H2,1-2H3,(H,30,31)