(2S)-1-[(E)-but-1-enyl]-2-ethenyl-5-ethoxy-3,4-dihydro-2H-pyrrol-1-ium

Systemtic Name: (2S)-1-[(E)-but-1-enyl]-2-ethenyl-5-ethoxy-3,4-dihydro-2H-pyrrol-1-ium Openeye Name: (2S)-1-[(E)-but-1-enyl]-5-ethoxy-2-vinyl-3,4-dihydro-2H-pyrrol-1-ium CAS Name: (2S)-1-[(E)-but-1-enyl]-2-ethenyl-5-ethoxy-3,4-dihydro-2H-pyrrol-1-ium IUPAC Name: (2S)-1-[(E)-but-1-enyl]-2-ethenyl-5-ethoxy-3,4-dihydro-2H-pyrrol-1-ium Traditional Name: (5S)-1-[(E)-but-1-enyl]-2-ethoxy-5-vinyl-1-pyrrolin-1-ium Formula: C12H20NO+ MolecularWeight: 194.2933

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C[N+]1=C(CCC1C=C)OCC

Isomeric SMILES

CC/C=C/[N+]1=C(CC[C@H]1C=C)OCC

InChI

InChI=1S/C12H20NO/c1-4-7-10-13-11(5-2)8-9-12(13)14-6-3/h5,7,10-11H,2,4,6,8-9H2,1,3H3/q+1/b10-7+/t11-/m1/s1