(E)-12-[1-[(E)-9-(1-oxidanidylpyridin-1-ium-3-yl)non-3-enyl]pyridin-1-ium-3-yl]dodec-3-en-1-ol

Systemtic Name: (E)-12-[1-[(E)-9-(1-oxidanidylpyridin-1-ium-3-yl)non-3-enyl]pyridin-1-ium-3-yl]dodec-3-en-1-ol Openeye Name: (E)-12-[1-[(E)-9-(1-oxidopyridin-1-ium-3-yl)non-3-enyl]pyridin-1-ium-3-yl]dodec-3-en-1-ol CAS Name: (E)-12-[1-[(E)-9-(1-oxido-3-pyridin-1-iumyl)non-3-enyl]-3-pyridin-1-iumyl]-3-dodecen-1-ol IUPAC Name: (E)-12-[1-[(E)-9-(1-oxidopyridin-1-ium-3-yl)non-3-enyl]pyridin-1-ium-3-yl]dodec-3-en-1-ol Traditional Name: (E)-12-[1-[(E)-9-(1-oxidopyridin-1-ium-3-yl)non-3-enyl]pyridin-1-ium-3-yl]dodec-3-en-1-ol Formula: C31H47N2O2+ MolecularWeight: 479.71708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CCC=CCCCCCC2=C[N+](=CC=C2)[O-])CCCCCCCCC=CCCO

Isomeric SMILES

C1=CC(=C[N+](=C1)CC/C=C/CCCCCC2=C[N+](=CC=C2)[O-])CCCCCCCC/C=C/CCO

InChI

InChI=1S/C31H47N2O2/c34-27-17-13-9-4-2-1-3-6-10-14-20-30-22-18-25-32(28-30)24-16-12-8-5-7-11-15-21-31-23-19-26-33(35)29-31/h8-9,12-13,18-19,22-23,25-26,28-29,34H,1-7,10-11,14-17,20-21,24,27H2/q+1/b12-8+,13-9+