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

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]quinoline-4-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-4-quinolinecarboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-2-(3,4-dimethylphenyl)cinchoninamide Formula: C32H36N4O MolecularWeight: 492.65444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCN(CC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCN(CC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C32H36N4O/c1-24-13-14-27(21-25(24)2)31-22-29(28-11-6-7-12-30(28)34-31)32(37)33-15-8-16-35-17-19-36(20-18-35)23-26-9-4-3-5-10-26/h3-7,9-14,21-22H,8,15-20,23H2,1-2H3,(H,33,37)