N-(1-cyanocyclohexyl)-N-methyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-N-methyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-(1-cyanocyclohexyl)-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-N-methyl-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(1-cyanocyclohexyl)-N-methyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-(1-cyanocyclohexyl)-N-methyl-acetamide Formula: C23H34N4O+2 MolecularWeight: 382.54226

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C[NH+]1CC[NH+](CC1)CC=CC2=CC=CC=C2)C3(CCCCC3)C#N

Isomeric SMILES

CN(C(=O)C[NH+]1CC[NH+](CC1)C/C=C/C2=CC=CC=C2)C3(CCCCC3)C#N

InChI

InChI=1S/C23H32N4O/c1-25(23(20-24)12-6-3-7-13-23)22(28)19-27-17-15-26(16-18-27)14-8-11-21-9-4-2-5-10-21/h2,4-5,8-11H,3,6-7,12-19H2,1H3/p+2/b11-8+