sodium 3-chloranyl-1-(4-methoxycarbonylphenyl)-4-oxidanylidene-2-sulfanyl-azetidine-2-thiolate

Systemtic Name: sodium 3-chloranyl-1-(4-methoxycarbonylphenyl)-4-oxidanylidene-2-sulfanyl-azetidine-2-thiolate Openeye Name: sodium 3-chloro-1-(4-methoxycarbonylphenyl)-4-oxo-2-sulfanyl-azetidine-2-thiolate CAS Name: sodium 3-chloro-2-mercapto-1-(4-methoxycarbonylphenyl)-4-oxo-2-azetidinethiolate IUPAC Name: sodium 3-chloro-1-(4-methoxycarbonylphenyl)-4-oxo-2-sulfanylazetidine-2-thiolate Traditional Name: sodium 1-(4-carbomethoxyphenyl)-3-chloro-4-keto-2-mercapto-azetidine-2-thiolate Formula: C11H9ClNNaO3S2 MolecularWeight: 325.76683

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=O)C(C2(S)[S-])Cl.[Na+]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=O)C(C2(S)[S-])Cl.[Na+]

InChI

InChI=1S/C11H10ClNO3S2.Na/c1-16-10(15)6-2-4-7(5-3-6)13-9(14)8(12)11(13,17)18;/h2-5,8,17-18H,1H3;/q;+1/p-1