2-(2,4-dimethoxyphenyl)-N-[(2S)-heptan-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-(2,4-dimethoxyphenyl)-N-[(2S)-heptan-2-yl]quinoline-4-carboxamide Openeye Name: 2-(2,4-dimethoxyphenyl)-N-[(1S)-1-methylhexyl]quinoline-4-carboxamide CAS Name: 2-(2,4-dimethoxyphenyl)-N-[(2S)-heptan-2-yl]-4-quinolinecarboxamide IUPAC Name: 2-(2,4-dimethoxyphenyl)-N-[(2S)-heptan-2-yl]quinoline-4-carboxamide Traditional Name: 2-(2,4-dimethoxyphenyl)-N-[(1S)-1-methylhexyl]cinchoninamide Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC[C@H](C)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C25H30N2O3/c1-5-6-7-10-17(2)26-25(28)21-16-23(27-22-12-9-8-11-19(21)22)20-14-13-18(29-3)15-24(20)30-4/h8-9,11-17H,5-7,10H2,1-4H3,(H,26,28)/t17-/m0/s1