6-azanyl-3,3,6-trimethyl-7-oxidanylidene-2-sulfo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-azanyl-3,3,6-trimethyl-7-oxidanylidene-2-sulfo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-amino-3,3,6-trimethyl-7-oxo-2-sulfo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-amino-3,3,6-trimethyl-7-oxo-2-sulfo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-amino-3,3,6-trimethyl-7-oxo-2-sulfo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-amino-7-keto-3,3,6-trimethyl-2-sulfo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C9H14N2O6S2 MolecularWeight: 310.34726

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)(C)N)(C(=O)O)S(=O)(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)(C)N)(C(=O)O)S(=O)(=O)O)C

InChI

InChI=1S/C9H14N2O6S2/c1-7(2)9(6(13)14,19(15,16)17)11-4(12)8(3,10)5(11)18-7/h5H,10H2,1-3H3,(H,13,14)(H,15,16,17)