(s)-trans-3-(1-Methyl-pyrrolidin-2-yl)-1-oct-3-enyl-pyridinium bromide hydrobromide salt

HCID 69596201
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Basic information

Standard SMILES
Br.CCCC/C=C/CC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-]
InChIKey
WXPHFMXXCBRTOQ-JAZOHYEMSA-M
Molecular formula
C18H30Br2N2
Average molar mass
434.3 g/mol

Names & identifiers

Preferred name
(s)-trans-3-(1-Methyl-pyrrolidin-2-yl)-1-oct-3-enyl-pyridinium bromide hydrobromide salt
IUPAC
3-[(2S)-1-methylpyrrolidin-2-yl]-1-[(E)-oct-3-enyl]pyridin-1-ium;bromide;hydrobromide

Names & synonyms

SCHEMBL5883384WXPHFMXXCBRTOQ-JAZOHYEMSA-M(s)-trans-3-(1-methyl-pyrrolidin-2-yl)-1-oct-3-enyl-pyridinium bromide hydrobromide salt

Database identifiers

PubChem CID
69596201

Properties

Computed structural properties

Topological polar surface area
7.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
22

Related reactions

1 records
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Linked notes

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