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

Systemtic Name: N-[2-(2-methylpiperidin-1-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: N-[2-(2-methyl-1-piperidyl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide CAS Name: N-[2-(2-methyl-1-piperidinyl)ethyl]-2-[4-(1-oxopropylamino)phenyl]-4-quinolinecarboxamide IUPAC Name: N-[2-(2-methylpiperidin-1-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: N-[2-(2-methylpiperidino)ethyl]-2-(4-propionamidophenyl)cinchoninamide Formula: C27H32N4O2 MolecularWeight: 444.56858

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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)NCCN4CCCCC4C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCN4CCCCC4C

InChI

InChI=1S/C27H32N4O2/c1-3-26(32)29-21-13-11-20(12-14-21)25-18-23(22-9-4-5-10-24(22)30-25)27(33)28-15-17-31-16-7-6-8-19(31)2/h4-5,9-14,18-19H,3,6-8,15-17H2,1-2H3,(H,28,33)(H,29,32)