[2-(5-methylfuran-2-yl)quinolin-4-yl]-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: [2-(5-methylfuran-2-yl)quinolin-4-yl]-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone Openeye Name: [4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-[2-(5-methyl-2-furyl)-4-quinolyl]methanone CAS Name: [2-(5-methyl-2-furanyl)-4-quinolinyl]-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methanone IUPAC Name: [2-(5-methylfuran-2-yl)quinolin-4-yl]-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone Traditional Name: [4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-[2-(5-methyl-2-furyl)-4-quinolyl]methanone Formula: C28H28N3O2+ MolecularWeight: 438.54082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CC[NH+](CC4)CC=CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(O1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CC[NH+](CC4)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C28H27N3O2/c1-21-13-14-27(33-21)26-20-24(23-11-5-6-12-25(23)29-26)28(32)31-18-16-30(17-19-31)15-7-10-22-8-3-2-4-9-22/h2-14,20H,15-19H2,1H3/p+1/b10-7+