N-[3-(3-methylpiperidin-1-yl)propyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide

Systemtic Name: N-[3-(3-methylpiperidin-1-yl)propyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: N-[3-(3-methyl-1-piperidyl)propyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide CAS Name: N-[3-(3-methyl-1-piperidinyl)propyl]-2-[4-(1-oxopropylamino)phenyl]-4-quinolinecarboxamide IUPAC Name: N-[3-(3-methylpiperidin-1-yl)propyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: N-[3-(3-methylpiperidino)propyl]-2-(4-propionamidophenyl)cinchoninamide Formula: C28H34N4O2 MolecularWeight: 458.59516

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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)NCCCN4CCCC(C4)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCCC(C4)C

InChI

InChI=1S/C28H34N4O2/c1-3-27(33)30-22-13-11-21(12-14-22)26-18-24(23-9-4-5-10-25(23)31-26)28(34)29-15-7-17-32-16-6-8-20(2)19-32/h4-5,9-14,18,20H,3,6-8,15-17,19H2,1-2H3,(H,29,34)(H,30,33)