N-(cyclohexylcarbamoyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(cyclohexylcarbamoyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(cyclohexylcarbamoyl)acetamide CAS Name: 2-(4-benzoyl-1-piperazin-1-iumyl)-N-[(cyclohexylamino)-oxomethyl]acetamide IUPAC Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(cyclohexylcarbamoyl)acetamide Traditional Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(cyclohexylcarbamoyl)acetamide Formula: C20H29N4O3+ MolecularWeight: 373.46926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O3/c25-18(22-20(27)21-17-9-5-2-6-10-17)15-23-11-13-24(14-12-23)19(26)16-7-3-1-4-8-16/h1,3-4,7-8,17H,2,5-6,9-15H2,(H2,21,22,25,27)/p+1