(2S,6S)-1,1-dimethyl-2,6-bis[(E)-2-phenylethenyl]piperidin-1-ium iodide

Systemtic Name: (2S,6S)-1,1-dimethyl-2,6-bis[(E)-2-phenylethenyl]piperidin-1-ium iodide Openeye Name: (2S,6S)-1,1-dimethyl-2,6-bis[(E)-styryl]piperidin-1-ium iodide CAS Name: (2S,6S)-1,1-dimethyl-2,6-bis[(E)-2-phenylethenyl]piperidin-1-ium iodide IUPAC Name: (2S,6S)-1,1-dimethyl-2,6-bis[(E)-2-phenylethenyl]piperidin-1-ium iodide Traditional Name: (2S,6S)-1,1-dimethyl-2,6-bis[(E)-styryl]piperidin-1-ium iodide Formula: C23H28IN MolecularWeight: 445.37959

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(CCCC1C=CC2=CC=CC=C2)C=CC3=CC=CC=C3)C.[I-]

Isomeric SMILES

C[N+]1([C@@H](CCC[C@H]1/C=C/C2=CC=CC=C2)/C=C/C3=CC=CC=C3)C.[I-]

InChI

InChI=1S/C23H28N.HI/c1-24(2)22(18-16-20-10-5-3-6-11-20)14-9-15-23(24)19-17-21-12-7-4-8-13-21;/h3-8,10-13,16-19,22-23H,9,14-15H2,1-2H3;1H/q+1;/p-1/b18-16+,19-17+;/t22-,23-;/m0./s1