2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]ethanamide

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]ethanamide Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]acetamide CAS Name: 2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-N-[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]acetamide IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]acetamide Traditional Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(cyclohexen-1-yl)ethylcarbamoyl]acetamide Formula: C21H30ClN4O2+ MolecularWeight: 405.9415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29ClN4O2/c22-18-7-4-8-19(15-18)26-13-11-25(12-14-26)16-20(27)24-21(28)23-10-9-17-5-2-1-3-6-17/h4-5,7-8,15H,1-3,6,9-14,16H2,(H2,23,24,27,28)/p+1