2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]ethanamide

Systemtic Name: 2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]ethanamide Openeye Name: 2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]acetamide CAS Name: 2-[4-[(2-chlorophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]acetamide IUPAC Name: 2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]acetamide Traditional Name: 2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]acetamide Formula: C22H30ClN4O3+ MolecularWeight: 433.9516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H29ClN4O3/c23-19-9-5-4-8-18(19)21(29)27-14-12-26(13-15-27)16-20(28)25-22(30)24-11-10-17-6-2-1-3-7-17/h4-6,8-9H,1-3,7,10-16H2,(H2,24,25,28,30)/p+1