2-[4-(phenylmethyl)piperazin-1-yl]-N-(2-propan-2-yloxyethyl)quinoline-4-carboxamide

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]-N-(2-propan-2-yloxyethyl)quinoline-4-carboxamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-(2-isopropoxyethyl)quinoline-4-carboxamide CAS Name: 2-[4-(phenylmethyl)-1-piperazinyl]-N-(2-propan-2-yloxyethyl)-4-quinolinecarboxamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-(2-propan-2-yloxyethyl)quinoline-4-carboxamide Traditional Name: 2-(4-benzylpiperazino)-N-(2-isopropoxyethyl)cinchoninamide Formula: C26H32N4O2 MolecularWeight: 432.55788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCNC(=O)C1=CC(=NC2=CC=CC=C21)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)OCCNC(=O)C1=CC(=NC2=CC=CC=C21)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2/c1-20(2)32-17-12-27-26(31)23-18-25(28-24-11-7-6-10-22(23)24)30-15-13-29(14-16-30)19-21-8-4-3-5-9-21/h3-11,18,20H,12-17,19H2,1-2H3,(H,27,31)