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

Systemtic Name: [2-(4-ethoxyphenyl)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-(4-ethoxyphenyl)-4-quinolyl]methanone CAS Name: [2-(4-ethoxyphenyl)-4-quinolinyl]-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methanone IUPAC Name: [2-(4-ethoxyphenyl)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-p-phenetyl-4-quinolyl)methanone Formula: C31H32N3O2+ MolecularWeight: 478.60468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CC[NH+](CC4)CC=CC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CC[NH+](CC4)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C31H31N3O2/c1-2-36-26-16-14-25(15-17-26)30-23-28(27-12-6-7-13-29(27)32-30)31(35)34-21-19-33(20-22-34)18-8-11-24-9-4-3-5-10-24/h3-17,23H,2,18-22H2,1H3/p+1/b11-8+