4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]benzamide

Systemtic Name: 4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]benzamide Openeye Name: 4-[[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methyl]benzamide CAS Name: 4-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methyl]benzamide IUPAC Name: 4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]benzamide Traditional Name: 4-[[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methyl]benzamide Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H25N3O/c22-21(25)20-10-8-19(9-11-20)17-24-15-13-23(14-16-24)12-4-7-18-5-2-1-3-6-18/h1-11H,12-17H2,(H2,22,25)/p+1/b7-4+