N-tert-butyl-2-[4-[2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide Formula: C22H37N5O3+2 MolecularWeight: 419.56088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3O

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3O

InChI

InChI=1S/C22H35N5O3/c1-22(2,3)23-20(29)16-24-10-14-27(15-11-24)21(30)17-25-8-12-26(13-9-25)18-6-4-5-7-19(18)28/h4-7,28H,8-17H2,1-3H3,(H,23,29)/p+2