(2R)-N-cyclohexyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: (2R)-N-cyclohexyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2R)-2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-cyclohexyl-propanamide CAS Name: (2R)-N-cyclohexyl-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2R)-N-cyclohexyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2R)-2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-cyclohexyl-propionamide Formula: C22H35N3O+2 MolecularWeight: 357.5328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)[NH+]2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)[NH+]2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H33N3O/c1-19(22(26)23-21-12-6-3-7-13-21)25-17-15-24(16-18-25)14-8-11-20-9-4-2-5-10-20/h2,4-5,8-11,19,21H,3,6-7,12-18H2,1H3,(H,23,26)/p+2/b11-8+/t19-/m1/s1