[1,1-bis(oxidanylidene)thiolan-3-yl]azanium; 4-methoxybenzoate

Systemtic Name: [1,1-bis(oxidanylidene)thiolan-3-yl]azanium; 4-methoxybenzoate Openeye Name: (1,1-dioxothiolan-3-yl)ammonium; 4-methoxybenzoate CAS Name: (1,1-dioxo-3-thiolanyl)ammonium; 4-methoxybenzoate IUPAC Name: (1,1-dioxothiolan-3-yl)azanium; 4-methoxybenzoate Traditional Name: (1,1-diketothiolan-3-yl)ammonium; 4-methoxybenzoate Formula: C12H17NO5S MolecularWeight: 287.33208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)[O-].C1CS(=O)(=O)CC1[NH3+]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)[O-].C1CS(=O)(=O)CC1[NH3+]

InChI

InChI=1S/C8H8O3.C4H9NO2S/c1-11-7-4-2-6(3-5-7)8(9)10;5-4-1-2-8(6,7)3-4/h2-5H,1H3,(H,9,10);4H,1-3,5H2