(2R)-N-methyl-N-phenyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: (2R)-N-methyl-N-phenyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2R)-2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-methyl-N-phenyl-propanamide CAS Name: (2R)-N-methyl-N-phenyl-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2R)-N-methyl-N-phenyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2R)-2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-N-methyl-N-phenyl-propionamide Formula: C23H31N3O+2 MolecularWeight: 365.51174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1=CC=CC=C1)[NH+]2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)N(C)C1=CC=CC=C1)[NH+]2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O/c1-20(23(27)24(2)22-13-7-4-8-14-22)26-18-16-25(17-19-26)15-9-12-21-10-5-3-6-11-21/h3-14,20H,15-19H2,1-2H3/p+2/b12-9+/t20-/m1/s1