2-(4-ethoxyphenyl)-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]quinoline-4-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide CAS Name: 2-(4-ethoxyphenyl)-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-4-quinolinecarboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-2-p-phenetyl-cinchoninamide Formula: C32H36N4O2 MolecularWeight: 508.65384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C32H36N4O2/c1-2-38-27-15-13-26(14-16-27)31-23-29(28-11-6-7-12-30(28)34-31)32(37)33-17-8-18-35-19-21-36(22-20-35)24-25-9-4-3-5-10-25/h3-7,9-16,23H,2,8,17-22,24H2,1H3,(H,33,37)