1-methyl-5-pyrrolidin-1-yl-3,4-dihydro-2H-pyrrol-1-ium iodide hydrate

Systemtic Name: 1-methyl-5-pyrrolidin-1-yl-3,4-dihydro-2H-pyrrol-1-ium iodide hydrate Openeye Name: 1-methyl-5-pyrrolidin-1-yl-3,4-dihydro-2H-pyrrol-1-ium iodide hydrate CAS Name: 1-methyl-5-(1-pyrrolidinyl)-3,4-dihydro-2H-pyrrol-1-ium iodide hydrate IUPAC Name: 1-methyl-5-pyrrolidin-1-yl-3,4-dihydro-2H-pyrrol-1-ium iodide hydrate Traditional Name: 1-methyl-2-pyrrolidino-1-pyrrolin-1-ium iodide hydrate Formula: C9H19IN2O MolecularWeight: 298.16443

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(CCC1)N2CCCC2.O.[I-]

Isomeric SMILES

C[N+]1=C(CCC1)N2CCCC2.O.[I-]

InChI

InChI=1S/C9H17N2.HI.H2O/c1-10-6-4-5-9(10)11-7-2-3-8-11;;/h2-8H2,1H3;1H;1H2/q+1;;/p-1