2-[4-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanoyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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