7-methyl-8-oxidanylidene-4-(triphenyl-$l^{5}-phosphanylidene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 7-methyl-8-oxidanylidene-4-(triphenyl-$l^{5}-phosphanylidene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 7-methyl-8-oxo-4-(triphenyl-$l^{5}-phosphanylidene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-methyl-8-oxo-4-triphenylphosphoranylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 7-methyl-8-oxo-4-(triphenyl-$l^{5}-phosphanylidene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-7-methyl-4-triphenylphosphoranylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C26H21NO3PS- MolecularWeight: 458.488601

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2N(C1=O)C(=CC(=P(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)S2)C(=O)[O-]

Isomeric SMILES

CC1C2N(C1=O)C(=CC(=P(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)S2)C(=O)[O-]

InChI

InChI=1S/C26H22NO3PS/c1-18-24(28)27-22(26(29)30)17-23(32-25(18)27)31(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-18,25H,1H3,(H,29,30)/p-1