N-cyclohexyl-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenyl-ethanamide Openeye Name: N-cyclohexyl-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenyl-acetamide CAS Name: N-cyclohexyl-2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-N-phenylacetamide IUPAC Name: N-cyclohexyl-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenylacetamide Traditional Name: N-cyclohexyl-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-N-phenyl-acetamide Formula: C25H34N3O2+ MolecularWeight: 408.55636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)N(C3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)N(C3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3O2/c1-30-24-14-12-21(13-15-24)27-18-16-26(17-19-27)20-25(29)28(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2,4-5,8-9,12-15,23H,3,6-7,10-11,16-20H2,1H3/p+1