N-[1-(4-bromophenyl)ethyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide

Systemtic Name: N-[1-(4-bromophenyl)ethyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide Openeye Name: N-[1-(4-bromophenyl)ethyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide CAS Name: N-[1-(4-bromophenyl)ethyl]-2-[4-(4-methoxyphenyl)-1-piperazinyl]-4-quinolinecarboxamide IUPAC Name: N-[1-(4-bromophenyl)ethyl]-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide Traditional Name: N-[1-(4-bromophenyl)ethyl]-2-[4-(4-methoxyphenyl)piperazino]cinchoninamide Formula: C29H29BrN4O2 MolecularWeight: 545.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)C2=CC(=NC3=CC=CC=C32)N4CCN(CC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(=O)C2=CC(=NC3=CC=CC=C32)N4CCN(CC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H29BrN4O2/c1-20(21-7-9-22(30)10-8-21)31-29(35)26-19-28(32-27-6-4-3-5-25(26)27)34-17-15-33(16-18-34)23-11-13-24(36-2)14-12-23/h3-14,19-20H,15-18H2,1-2H3,(H,31,35)