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

Systemtic Name: N-(cyclohexylmethyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide Openeye Name: N-(cyclohexylmethyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide CAS Name: N-(cyclohexylmethyl)-2-[4-(4-methoxyphenyl)-1-piperazinyl]-4-quinolinecarboxamide IUPAC Name: N-(cyclohexylmethyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxamide Traditional Name: N-(cyclohexylmethyl)-2-[4-(4-methoxyphenyl)piperazino]cinchoninamide Formula: C28H34N4O2 MolecularWeight: 458.59516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5CCCCC5

InChI

InChI=1S/C28H34N4O2/c1-34-23-13-11-22(12-14-23)31-15-17-32(18-16-31)27-19-25(24-9-5-6-10-26(24)30-27)28(33)29-20-21-7-3-2-4-8-21/h5-6,9-14,19,21H,2-4,7-8,15-18,20H2,1H3,(H,29,33)