N-(3-chloranyl-4-methoxy-phenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]quinoline-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]quinoline-4-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]quinoline-4-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[4-(4-fluorophenyl)-1-piperazinyl]-4-quinolinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]quinoline-4-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[4-(4-fluorophenyl)piperazino]cinchoninamide Formula: C27H24ClFN4O2 MolecularWeight: 490.956463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)N4CCN(CC4)C5=CC=C(C=C5)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)N4CCN(CC4)C5=CC=C(C=C5)F)Cl

InChI

InChI=1S/C27H24ClFN4O2/c1-35-25-11-8-19(16-23(25)28)30-27(34)22-17-26(31-24-5-3-2-4-21(22)24)33-14-12-32(13-15-33)20-9-6-18(29)7-10-20/h2-11,16-17H,12-15H2,1H3,(H,30,34)