6-(dimethylaminomethylideneamino)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid

Systemtic Name: 6-(dimethylaminomethylideneamino)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid Openeye Name: 6-(dimethylaminomethyleneamino)-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid CAS Name: 6-(dimethylaminomethylideneamino)-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid IUPAC Name: 6-(dimethylaminomethylideneamino)-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid Traditional Name: 6-(dimethylaminomethyleneamino)-7-keto-3,3-dimethyl-4-thia-1-azoniabicyclo[3.2.0]heptane-1-carboxylic acid Formula: C11H18N3O3S+ MolecularWeight: 272.34392

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C[N+]2(C(S1)C(C2=O)N=CN(C)C)C(=O)O)C

Isomeric SMILES

CC1(C[N+]2(C(S1)C(C2=O)N=CN(C)C)C(=O)O)C

InChI

InChI=1S/C11H17N3O3S/c1-11(2)5-14(10(16)17)8(15)7(9(14)18-11)12-6-13(3)4/h6-7,9H,5H2,1-4H3/p+1