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

Systemtic Name: N-(diphenylmethyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-benzhydryl-2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(diphenylmethyl)-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-benzhydryl-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-benzhydryl-2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]acetamide Formula: C28H32N3O+ MolecularWeight: 426.57318

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)CC=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O/c32-27(29-28(25-14-6-2-7-15-25)26-16-8-3-9-17-26)23-31-21-19-30(20-22-31)18-10-13-24-11-4-1-5-12-24/h1-17,28H,18-23H2,(H,29,32)/p+1/b13-10+