1-dodecyl-2-[(Z)-2-phenyl-1-piperidin-1-yl-ethenyl]pyridin-1-ium bromide

Systemtic Name: 1-dodecyl-2-[(Z)-2-phenyl-1-piperidin-1-yl-ethenyl]pyridin-1-ium bromide Openeye Name: 1-dodecyl-2-[(Z)-2-phenyl-1-(1-piperidyl)vinyl]pyridin-1-ium bromide CAS Name: 1-dodecyl-2-[(Z)-2-phenyl-1-(1-piperidinyl)ethenyl]pyridin-1-ium bromide IUPAC Name: 1-dodecyl-2-[(Z)-2-phenyl-1-piperidin-1-ylethenyl]pyridin-1-ium bromide Traditional Name: 1-lauryl-2-[(Z)-2-phenyl-1-piperidino-vinyl]pyridin-1-ium bromide Formula: C30H45BrN2 MolecularWeight: 513.5957

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC=CC=C1C(=CC2=CC=CC=C2)N3CCCCC3.[Br-]

Isomeric SMILES

CCCCCCCCCCCC[N+]1=CC=CC=C1/C(=C/C2=CC=CC=C2)/N3CCCCC3.[Br-]

InChI

InChI=1S/C30H45N2.BrH/c1-2-3-4-5-6-7-8-9-10-16-23-31-26-19-15-22-29(31)30(32-24-17-12-18-25-32)27-28-20-13-11-14-21-28;/h11,13-15,19-22,26-27H,2-10,12,16-18,23-25H2,1H3;1H/q+1;/p-1/b30-27-;