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

Systemtic Name: N-(1-adamantyl)-2-(3,4-dimethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-(1-adamantyl)-2-(3,4-dimethoxyphenyl)quinoline-4-carboxamide CAS Name: N-(1-adamantyl)-2-(3,4-dimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-(1-adamantyl)-2-(3,4-dimethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-(1-adamantyl)-2-(3,4-dimethoxyphenyl)cinchoninamide Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC45CC6CC(C4)CC(C6)C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC45CC6CC(C4)CC(C6)C5)OC

InChI

InChI=1S/C28H30N2O3/c1-32-25-8-7-20(12-26(25)33-2)24-13-22(21-5-3-4-6-23(21)29-24)27(31)30-28-14-17-9-18(15-28)11-19(10-17)16-28/h3-8,12-13,17-19H,9-11,14-16H2,1-2H3,(H,30,31)