N-(1-adamantyl)-N-ethyl-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-(1-adamantyl)-N-ethyl-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-(1-adamantyl)-N-ethyl-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-(1-adamantyl)-N-ethyl-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-(1-adamantyl)-N-ethyl-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-(1-adamantyl)-N-ethyl-2-(4-pyridyl)cinchoninamide Formula: C27H29N3O MolecularWeight: 411.53866

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCN(C(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H29N3O/c1-2-30(27-15-18-11-19(16-27)13-20(12-18)17-27)26(31)23-14-25(21-7-9-28-10-8-21)29-24-6-4-3-5-22(23)24/h3-10,14,18-20H,2,11-13,15-17H2,1H3