6-methoxycarbonyl-5-oxidanylidene-1-thia-4-azacyclotridecane-3-carboxylate

Systemtic Name: 6-methoxycarbonyl-5-oxidanylidene-1-thia-4-azacyclotridecane-3-carboxylate Openeye Name: 6-methoxycarbonyl-5-oxo-1-thia-4-azacyclotridecane-3-carboxylate CAS Name: 6-methoxycarbonyl-5-oxo-1-thia-4-azacyclotridecane-3-carboxylate IUPAC Name: 6-methoxycarbonyl-5-oxo-1-thia-4-azacyclotridecane-3-carboxylate Traditional Name: 6-carbomethoxy-5-keto-1-thia-4-azacyclotridecane-3-carboxylate Formula: C14H22NO5S- MolecularWeight: 316.39318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCCCCCSCC(NC1=O)C(=O)[O-]

Isomeric SMILES

COC(=O)C1CCCCCCCSCC(NC1=O)C(=O)[O-]

InChI

InChI=1S/C14H23NO5S/c1-20-14(19)10-7-5-3-2-4-6-8-21-9-11(13(17)18)15-12(10)16/h10-11H,2-9H2,1H3,(H,15,16)(H,17,18)/p-1