N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-methyl-N-[(5-methyl-2-furyl)methyl]acetamide CAS Name: N-methyl-N-[(5-methyl-2-furanyl)methyl]-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-methyl-N-[(5-methyl-2-furyl)methyl]acetamide Formula: C22H31N3O2+2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C(=O)C[NH+]2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(O1)CN(C)C(=O)C[NH+]2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O2/c1-19-10-11-21(27-19)17-23(2)22(26)18-25-15-13-24(14-16-25)12-6-9-20-7-4-3-5-8-20/h3-11H,12-18H2,1-2H3/p+2/b9-6+