N-(3-methylbutyl)-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide

Systemtic Name: N-(3-methylbutyl)-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: N-isopentyl-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide CAS Name: N-(3-methylbutyl)-2-[4-(1-oxopropylamino)phenyl]-4-quinolinecarboxamide IUPAC Name: N-(3-methylbutyl)-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: N-isoamyl-2-(4-propionamidophenyl)cinchoninamide Formula: C24H27N3O2 MolecularWeight: 389.49008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC(C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC(C)C

InChI

InChI=1S/C24H27N3O2/c1-4-23(28)26-18-11-9-17(10-12-18)22-15-20(24(29)25-14-13-16(2)3)19-7-5-6-8-21(19)27-22/h5-12,15-16H,4,13-14H2,1-3H3,(H,25,29)(H,26,28)