2-[4-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]ethanoyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]ethanoyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide Formula: C21H34ClN5O2+2 MolecularWeight: 423.97996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32ClN5O2/c1-17(2)23-20(28)15-24-8-12-27(13-9-24)21(29)16-25-6-10-26(11-7-25)19-5-3-4-18(22)14-19/h3-5,14,17H,6-13,15-16H2,1-2H3,(H,23,28)/p+2