N-(2,5-dimethoxyphenyl)-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: N-(2,5-dimethoxyphenyl)-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[4-(1-oxopropylamino)phenyl]-4-quinolinecarboxamide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: N-(2,5-dimethoxyphenyl)-2-(4-propionamidophenyl)cinchoninamide Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C27H25N3O4/c1-4-26(31)28-18-11-9-17(10-12-18)23-16-21(20-7-5-6-8-22(20)29-23)27(32)30-24-15-19(33-2)13-14-25(24)34-3/h5-16H,4H2,1-3H3,(H,28,31)(H,30,32)