[2-(diphenylmethyl)oxycarbonyl-7-formamido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl-triphenyl-phosphanium

Systemtic Name: [2-(diphenylmethyl)oxycarbonyl-7-formamido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl-triphenyl-phosphanium Openeye Name: (2-benzhydryloxycarbonyl-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl-triphenyl-phosphonium CAS Name: [2-[(diphenylmethyl)oxy-oxomethyl]-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl-triphenylphosphonium IUPAC Name: (2-benzhydryloxycarbonyl-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl-triphenylphosphanium Traditional Name: (2-benzhydryloxycarbonyl-7-formamido-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl-triphenyl-phosphonium Formula: C40H34N2O4PS+ MolecularWeight: 669.747721

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)NC=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)C[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)C[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C40H33N2O4PS/c43-28-41-35-38(44)42-36(40(45)46-37(29-16-6-1-7-17-29)30-18-8-2-9-19-30)31(27-48-39(35)42)26-47(32-20-10-3-11-21-32,33-22-12-4-13-23-33)34-24-14-5-15-25-34/h1-25,28,35,37,39H,26-27H2/p+1