N-(2-chlorophenyl)-2-[4-[3-(cyclohexylcarbamoylamino)propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-[4-[3-(cyclohexylcarbamoylamino)propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-chlorophenyl)-2-[4-[3-(cyclohexylcarbamoylamino)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-chlorophenyl)-2-[4-[3-[[(cyclohexylamino)-oxomethyl]amino]-1-oxopropyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-chlorophenyl)-2-[4-[3-(cyclohexylcarbamoylamino)propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-chlorophenyl)-2-[4-[3-(cyclohexylcarbamoylamino)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C22H33ClN5O3+ MolecularWeight: 450.98212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCCC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

C1CCC(CC1)NC(=O)NCCC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C22H32ClN5O3/c23-18-8-4-5-9-19(18)26-20(29)16-27-12-14-28(15-13-27)21(30)10-11-24-22(31)25-17-6-2-1-3-7-17/h4-5,8-9,17H,1-3,6-7,10-16H2,(H,26,29)(H2,24,25,31)/p+1