1-[(1R,3R)-3-methylcyclohexyl]-4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium

Systemtic Name: 1-[(1R,3R)-3-methylcyclohexyl]-4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium Openeye Name: 1-[(E)-cinnamyl]-4-[(1R,3R)-3-methylcyclohexyl]piperazine-1,4-diium CAS Name: 1-[(1R,3R)-3-methylcyclohexyl]-4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium IUPAC Name: 1-[(1R,3R)-3-methylcyclohexyl]-4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium Traditional Name: 1-[(E)-cinnamyl]-4-[(1R,3R)-3-methylcyclohexyl]piperazine-1,4-diium Formula: C20H32N2+2 MolecularWeight: 300.48148

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)[NH+]2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CCC[C@H](C1)[NH+]2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H30N2/c1-18-7-5-11-20(17-18)22-15-13-21(14-16-22)12-6-10-19-8-3-2-4-9-19/h2-4,6,8-10,18,20H,5,7,11-17H2,1H3/p+2/b10-6+/t18-,20-/m1/s1