oxidanylidene-prop-2-enyl-(1-sulfopropyl)azanium

Systemtic Name: oxidanylidene-prop-2-enyl-(1-sulfopropyl)azanium Openeye Name: allyl-oxo-(1-sulfopropyl)ammonium CAS Name: oxo-prop-2-enyl-(1-sulfopropyl)ammonium IUPAC Name: oxo-prop-2-enyl-(1-sulfopropyl)azanium Traditional Name: allyl-keto-(1-sulfopropyl)ammonium Formula: C6H12NO4S+ MolecularWeight: 194.22878

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Descriptors Computed from Structure

Canonical SMILES:

CCC([N+](=O)CC=C)S(=O)(=O)O

Isomeric SMILES

CCC([N+](=O)CC=C)S(=O)(=O)O

InChI

InChI=1S/C6H11NO4S/c1-3-5-7(8)6(4-2)12(9,10)11/h3,6H,1,4-5H2,2H3/p+1