2-(4-methylphenyl)-N-[1-[2-oxidanylidene-2-(propylamino)ethyl]piperidin-4-yl]quinoline-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-[1-[2-oxidanylidene-2-(propylamino)ethyl]piperidin-4-yl]quinoline-4-carboxamide Openeye Name: N-[1-[2-oxo-2-(propylamino)ethyl]-4-piperidyl]-2-(p-tolyl)quinoline-4-carboxamide CAS Name: 2-(4-methylphenyl)-N-[1-[2-oxo-2-(propylamino)ethyl]-4-piperidinyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-methylphenyl)-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]quinoline-4-carboxamide Traditional Name: N-[1-[2-keto-2-(propylamino)ethyl]-4-piperidyl]-2-(p-tolyl)cinchoninamide Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C

Isomeric SMILES

CCCNC(=O)CN1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C

InChI

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