2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-(3-methoxypropyl)azaniumyl]-2-methyl-propanoate

Systemtic Name: 2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-(3-methoxypropyl)azaniumyl]-2-methyl-propanoate Openeye Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]-(3-methoxypropyl)ammonio]-2-methyl-propanoate CAS Name: 2-[[(3S)-1,1-dioxo-3-thiolanyl]-(3-methoxypropyl)ammonio]-2-methylpropanoate IUPAC Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]-(3-methoxypropyl)azaniumyl]-2-methylpropanoate Traditional Name: 2-[[(3S)-1,1-diketothiolan-3-yl]-(3-methoxypropyl)ammonio]-2-methyl-propionate Formula: C12H23NO5S MolecularWeight: 293.37972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)[O-])[NH+](CCCOC)C1CCS(=O)(=O)C1

Isomeric SMILES

CC(C)(C(=O)[O-])[NH+](CCCOC)[C@H]1CCS(=O)(=O)C1

InChI

InChI=1S/C12H23NO5S/c1-12(2,11(14)15)13(6-4-7-18-3)10-5-8-19(16,17)9-10/h10H,4-9H2,1-3H3,(H,14,15)/t10-/m0/s1