1-(1-methylpiperidin-1-ium-4-yl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium

Systemtic Name: 1-(1-methylpiperidin-1-ium-4-yl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium Openeye Name: 1-[(E)-cinnamyl]-4-(1-methylpiperidin-1-ium-4-yl)piperazine-1,4-diium CAS Name: 1-(1-methyl-4-piperidin-1-iumyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium IUPAC Name: 1-(1-methylpiperidin-1-ium-4-yl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium Traditional Name: 1-[(E)-cinnamyl]-4-(1-methylpiperidin-1-ium-4-yl)piperazine-1,4-diium Formula: C19H32N3+3 MolecularWeight: 302.47748

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H29N3/c1-20-12-9-19(10-13-20)22-16-14-21(15-17-22)11-5-8-18-6-3-2-4-7-18/h2-8,19H,9-17H2,1H3/p+3/b8-5+