(diphenylmethyl) 7-acetamido-8-oxidanylidene-3-propanoylperoxycarbonyl-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 7-acetamido-8-oxidanylidene-3-propanoylperoxycarbonyl-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate Openeye Name: benzhydryl 7-acetamido-8-oxo-3-propanoylperoxycarbonyl-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate CAS Name: 7-acetamido-8-oxo-3-[oxo(1-oxopropyldioxy)methyl]-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-acetamido-8-oxo-3-propanoylperoxycarbonyl-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate Traditional Name: 7-acetamido-8-keto-3-propionylperoxycarbonyl-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid benzhydryl ester Formula: C26H24N2O8S MolecularWeight: 524.54236

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OOC(=O)C1=CSC2C(C(=O)N2C1C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C

Isomeric SMILES

CCC(=O)OOC(=O)C1=CSC2C(C(=O)N2C1C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C

InChI

InChI=1S/C26H24N2O8S/c1-3-19(30)35-36-25(32)18-14-37-24-20(27-15(2)29)23(31)28(24)21(18)26(33)34-22(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-14,20-22,24H,3H2,1-2H3,(H,27,29)