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

Systemtic Name: (diphenylmethyl) 7-acetamido-8-oxidanylidene-3-(propan-2-yloxycarbonylamino)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate Openeye Name: benzhydryl 7-acetamido-3-(isopropoxycarbonylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate CAS Name: 7-acetamido-8-oxo-3-[[oxo(propan-2-yloxy)methyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-acetamido-8-oxo-3-(propan-2-yloxycarbonylamino)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate Traditional Name: 7-acetamido-3-(isopropoxycarbonylamino)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid benzhydryl ester Formula: C26H27N3O6S MolecularWeight: 509.57408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC1=CSC2C(C(=O)N2C1C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C

Isomeric SMILES

CC(C)OC(=O)NC1=CSC2C(C(=O)N2C1C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C

InChI

InChI=1S/C26H27N3O6S/c1-15(2)34-26(33)28-19-14-36-24-20(27-16(3)30)23(31)29(24)21(19)25(32)35-22(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-15,20-22,24H,1-3H3,(H,27,30)(H,28,33)