N-(1-oxidanylidene-3-phenyl-propan-2-yl)-2-(4-phenylpiperazin-1-yl)quinoline-4-carboxamide

Systemtic Name: N-(1-oxidanylidene-3-phenyl-propan-2-yl)-2-(4-phenylpiperazin-1-yl)quinoline-4-carboxamide Openeye Name: N-(1-benzyl-2-oxo-ethyl)-2-(4-phenylpiperazin-1-yl)quinoline-4-carboxamide CAS Name: N-(1-oxo-3-phenylpropan-2-yl)-2-(4-phenyl-1-piperazinyl)-4-quinolinecarboxamide IUPAC Name: N-(1-oxo-3-phenylpropan-2-yl)-2-(4-phenylpiperazin-1-yl)quinoline-4-carboxamide Traditional Name: N-(1-benzyl-2-keto-ethyl)-2-(4-phenylpiperazino)cinchoninamide Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC(CC5=CC=CC=C5)C=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)NC(CC5=CC=CC=C5)C=O

InChI

InChI=1S/C29H28N4O2/c34-21-23(19-22-9-3-1-4-10-22)30-29(35)26-20-28(31-27-14-8-7-13-25(26)27)33-17-15-32(16-18-33)24-11-5-2-6-12-24/h1-14,20-21,23H,15-19H2,(H,30,35)