cyclohexyl-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone chloride

Systemtic Name: cyclohexyl-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone chloride Openeye Name: [4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-cyclohexyl-methanone chloride CAS Name: cyclohexyl-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methanone chloride IUPAC Name: cyclohexyl-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone chloride Traditional Name: [4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-cyclohexyl-methanone chloride Formula: C20H29ClN2O MolecularWeight: 348.91006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CC[NH+](CC2)CC=CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1CCC(CC1)C(=O)N2CC[NH+](CC2)C/C=C/C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H28N2O.ClH/c23-20(19-11-5-2-6-12-19)22-16-14-21(15-17-22)13-7-10-18-8-3-1-4-9-18;/h1,3-4,7-10,19H,2,5-6,11-17H2;1H/b10-7+;