2-(4-butoxy-3-methoxy-phenyl)-N-(2-ethylhexyl)quinoline-4-carboxamide

Systemtic Name: 2-(4-butoxy-3-methoxy-phenyl)-N-(2-ethylhexyl)quinoline-4-carboxamide Openeye Name: 2-(4-butoxy-3-methoxy-phenyl)-N-(2-ethylhexyl)quinoline-4-carboxamide CAS Name: 2-(4-butoxy-3-methoxyphenyl)-N-(2-ethylhexyl)-4-quinolinecarboxamide IUPAC Name: 2-(4-butoxy-3-methoxyphenyl)-N-(2-ethylhexyl)quinoline-4-carboxamide Traditional Name: 2-(4-butoxy-3-methoxy-phenyl)-N-(2-ethylhexyl)cinchoninamide Formula: C29H38N2O3 MolecularWeight: 462.62362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)OCCCC)OC

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)OCCCC)OC

InChI

InChI=1S/C29H38N2O3/c1-5-8-12-21(7-3)20-30-29(32)24-19-26(31-25-14-11-10-13-23(24)25)22-15-16-27(28(18-22)33-4)34-17-9-6-2/h10-11,13-16,18-19,21H,5-9,12,17,20H2,1-4H3,(H,30,32)