4,6-dimethyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]pyrimidine

Systemtic Name: 4,6-dimethyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]pyrimidine Openeye Name: 2-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-4,6-dimethyl-pyrimidine CAS Name: 4,6-dimethyl-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]pyrimidine IUPAC Name: 4,6-dimethyl-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]pyrimidine Traditional Name: 2-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-4,6-dimethyl-pyrimidine Formula: C19H25N4+ MolecularWeight: 309.4286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CC[NH+](CC2)CC=CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CC[NH+](CC2)C/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C19H24N4/c1-16-15-17(2)21-19(20-16)23-13-11-22(12-14-23)10-6-9-18-7-4-3-5-8-18/h3-9,15H,10-14H2,1-2H3/p+1/b9-6+