4-[(E)-3-[(2S)-1-methylpyrrolidin-1-ium-2-yl]prop-2-enyl]morpholin-4-ium

Systemtic Name: 4-[(E)-3-[(2S)-1-methylpyrrolidin-1-ium-2-yl]prop-2-enyl]morpholin-4-ium Openeye Name: 4-[(E)-3-[(2S)-1-methylpyrrolidin-1-ium-2-yl]allyl]morpholin-4-ium CAS Name: 4-[(E)-3-[(2S)-1-methyl-2-pyrrolidin-1-iumyl]prop-2-enyl]morpholin-4-ium IUPAC Name: 4-[(E)-3-[(2S)-1-methylpyrrolidin-1-ium-2-yl]prop-2-enyl]morpholin-4-ium Traditional Name: 4-[(E)-3-[(2S)-1-methylpyrrolidin-1-ium-2-yl]allyl]morpholin-4-ium Formula: C12H24N2O+2 MolecularWeight: 212.33176

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC1C=CC[NH+]2CCOCC2

Isomeric SMILES

C[NH+]1CCC[C@H]1/C=C/C[NH+]2CCOCC2

InChI

InChI=1S/C12H22N2O/c1-13-6-2-4-12(13)5-3-7-14-8-10-15-11-9-14/h3,5,12H,2,4,6-11H2,1H3/p+2/b5-3+/t12-/m0/s1