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

Systemtic Name: [2-(4-phenylphenyl)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-phenylphenyl)-4-quinolyl]methanone CAS Name: [2-(4-phenylphenyl)-4-quinolinyl]-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methanone IUPAC Name: [2-(4-phenylphenyl)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-(4-phenylphenyl)-4-quinolyl]methanone Formula: C35H32N3O+ MolecularWeight: 510.64808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H31N3O/c39-35(38-24-22-37(23-25-38)21-9-12-27-10-3-1-4-11-27)32-26-34(36-33-16-8-7-15-31(32)33)30-19-17-29(18-20-30)28-13-5-2-6-14-28/h1-20,26H,21-25H2/p+1/b12-9+