2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[4-(2-methylbutan-2-yl)cyclohexyl]ethanamide

Systemtic Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[4-(2-methylbutan-2-yl)cyclohexyl]ethanamide Openeye Name: N-[4-(1,1-dimethylpropyl)cyclohexyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide IUPAC Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide Traditional Name: N-(4-tert-amylcyclohexyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C23H38N3O2+ MolecularWeight: 388.56672

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C23H37N3O2/c1-4-23(2,3)18-5-7-19(8-6-18)24-22(28)17-25-13-15-26(16-14-25)20-9-11-21(27)12-10-20/h9-12,18-19,27H,4-8,13-17H2,1-3H3,(H,24,28)/p+1