3-(2-bromanylethanoyl)-6,9-dithia-3-azaspiro[4.4]nonane-2-carboxylic acid

Systemtic Name: 3-(2-bromanylethanoyl)-6,9-dithia-3-azaspiro[4.4]nonane-2-carboxylic acid Openeye Name: 3-(2-bromoacetyl)-6,9-dithia-3-azaspiro[4.4]nonane-2-carboxylic acid CAS Name: 3-(2-bromo-1-oxoethyl)-6,9-dithia-3-azaspiro[4.4]nonane-2-carboxylic acid IUPAC Name: 3-(2-bromoacetyl)-6,9-dithia-3-azaspiro[4.4]nonane-2-carboxylic acid Traditional Name: 3-(2-bromoacetyl)-6,9-dithia-3-azaspiro[4.4]nonane-2-carboxylic acid Formula: C9H12BrNO3S2 MolecularWeight: 326.23048

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2(S1)CC(N(C2)C(=O)CBr)C(=O)O

Isomeric SMILES

C1CSC2(S1)CC(N(C2)C(=O)CBr)C(=O)O

InChI

InChI=1S/C9H12BrNO3S2/c10-4-7(12)11-5-9(15-1-2-16-9)3-6(11)8(13)14/h6H,1-5H2,(H,13,14)