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

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: N-[(4-ethoxyphenyl)methyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-[(4-ethoxyphenyl)methyl]-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-[(4-ethoxyphenyl)methyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-(4-ethoxybenzyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(C)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(C)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C22H29N3O3/c1-3-28-21-10-4-18(5-11-21)16-23(2)22(27)17-24-12-14-25(15-13-24)19-6-8-20(26)9-7-19/h4-11,26H,3,12-17H2,1-2H3/p+1