1-phenyl-2-[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-ylidene]-3H-benzimidazol-1-yl]ethanone

Systemtic Name: 1-phenyl-2-[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-ylidene]-3H-benzimidazol-1-yl]ethanone Openeye Name: 2-[2-[4-[(E)-cinnamyl]piperazin-1-ium-1-ylidene]-3H-benzimidazol-1-yl]-1-phenyl-ethanone CAS Name: 1-phenyl-2-[2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-1-iumylidene]-3H-benzimidazol-1-yl]ethanone IUPAC Name: 1-phenyl-2-[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-ylidene]-3H-benzimidazol-1-yl]ethanone Traditional Name: 2-[2-[4-[(E)-cinnamyl]piperazin-1-ium-1-ylidene]-3H-benzimidazol-1-yl]-1-phenyl-ethanone Formula: C28H29N4O+ MolecularWeight: 437.55606

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C2NC3=CC=CC=C3N2CC(=O)C4=CC=CC=C4)CCN1CC=CC5=CC=CC=C5

Isomeric SMILES

C1C[N+](=C2NC3=CC=CC=C3N2CC(=O)C4=CC=CC=C4)CCN1C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O/c33-27(24-13-5-2-6-14-24)22-32-26-16-8-7-15-25(26)29-28(32)31-20-18-30(19-21-31)17-9-12-23-10-3-1-4-11-23/h1-16H,17-22H2/p+1/b12-9+