N-[(2R)-4-phenylbutan-2-yl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(2R)-4-phenylbutan-2-yl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-[(1R)-1-methyl-3-phenyl-propyl]acetamide CAS Name: N-[(2R)-4-phenylbutan-2-yl]-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2R)-4-phenylbutan-2-yl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-[(1R)-1-methyl-3-phenyl-propyl]acetamide Formula: C25H34N3O+ MolecularWeight: 392.55696

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O/c1-22(14-15-24-11-6-3-7-12-24)26-25(29)21-28-19-17-27(18-20-28)16-8-13-23-9-4-2-5-10-23/h2-13,22H,14-21H2,1H3,(H,26,29)/p+1/b13-8+/t22-/m1/s1