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

Systemtic Name: N-(2-ethylbutyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide Openeye Name: N-(2-ethylbutyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide CAS Name: N-(2-ethylbutyl)-2-[4-(4-methoxyphenyl)-1-piperazinyl]-4-quinolinecarboxamide IUPAC Name: N-(2-ethylbutyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide Traditional Name: N-(2-ethylbutyl)-2-[4-(4-methoxyphenyl)piperazino]cinchoninamide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CNC(=O)C1=CC(=NC2=CC=CC=C21)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC(CC)CNC(=O)C1=CC(=NC2=CC=CC=C21)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H34N4O2/c1-4-20(5-2)19-28-27(32)24-18-26(29-25-9-7-6-8-23(24)25)31-16-14-30(15-17-31)21-10-12-22(33-3)13-11-21/h6-13,18,20H,4-5,14-17,19H2,1-3H3,(H,28,32)