2-(2-oxidanylidene-4-pyridin-3-ylcarbonylsulfanyl-azetidin-1-yl)-2-(triphenyl-$l^{5}-phosphanylidene)ethanoic acid

Systemtic Name: 2-(2-oxidanylidene-4-pyridin-3-ylcarbonylsulfanyl-azetidin-1-yl)-2-(triphenyl-$l^{5}-phosphanylidene)ethanoic acid Openeye Name: 2-[2-oxo-4-(pyridine-3-carbonylsulfanyl)azetidin-1-yl]-2-(triphenyl-$l^{5}-phosphanylidene)acetic acid CAS Name: 2-[2-oxo-4-[[oxo(3-pyridinyl)methyl]thio]-1-azetidinyl]-2-triphenylphosphoranylideneacetic acid IUPAC Name: 2-[2-oxo-4-(pyridine-3-carbonylsulfanyl)azetidin-1-yl]-2-(triphenyl-$l^{5}-phosphanylidene)acetic acid Traditional Name: 2-[2-keto-4-(nicotinoylthio)azetidin-1-yl]-2-triphenylphosphoranylidene-acetic acid Formula: C29H23N2O4PS MolecularWeight: 526.542681

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C1=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)SC(=O)C5=CN=CC=C5

Isomeric SMILES

C1C(N(C1=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)SC(=O)C5=CN=CC=C5

InChI

InChI=1S/C29H23N2O4PS/c32-25-19-26(37-29(35)21-11-10-18-30-20-21)31(25)27(28(33)34)36(22-12-4-1-5-13-22,23-14-6-2-7-15-23)24-16-8-3-9-17-24/h1-18,20,26H,19H2,(H,33,34)