2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]-N-methyl-acetamide CAS Name: 2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-N-[(3-methoxyphenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]-N-methylacetamide Traditional Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-m-anisyl-N-methyl-acetamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)OC)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CN(CC1=CC(=CC=C1)OC)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H27N3O3/c1-22(15-17-4-3-5-20(14-17)27-2)21(26)16-23-10-12-24(13-11-23)18-6-8-19(25)9-7-18/h3-9,14,25H,10-13,15-16H2,1-2H3/p+1