2-(4-ethylphenyl)-N-heptan-2-yl-quinoline-4-carboxamide

Systemtic Name: 2-(4-ethylphenyl)-N-heptan-2-yl-quinoline-4-carboxamide Openeye Name: 2-(4-ethylphenyl)-N-(1-methylhexyl)quinoline-4-carboxamide CAS Name: 2-(4-ethylphenyl)-N-heptan-2-yl-4-quinolinecarboxamide IUPAC Name: 2-(4-ethylphenyl)-N-heptan-2-ylquinoline-4-carboxamide Traditional Name: 2-(4-ethylphenyl)-N-(1-methylhexyl)cinchoninamide Formula: C25H30N2O MolecularWeight: 374.5185

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)CC

Isomeric SMILES

CCCCCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)CC

InChI

InChI=1S/C25H30N2O/c1-4-6-7-10-18(3)26-25(28)22-17-24(20-15-13-19(5-2)14-16-20)27-23-12-9-8-11-21(22)23/h8-9,11-18H,4-7,10H2,1-3H3,(H,26,28)