(2-oxidanyl-2-sulfanylidene-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl octadecanoate

Systemtic Name: (2-oxidanyl-2-sulfanylidene-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl octadecanoate Openeye Name: (2-hydroxy-2-thioxo-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl octadecanoate CAS Name: octadecanoic acid (2-hydroxy-2-sulfanylidene-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl ester IUPAC Name: (2-hydroxy-2-sulfanylidene-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl octadecanoate Traditional Name: stearic acid (2-hydroxy-2-thioxo-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl ester Formula: C21H41O5PS MolecularWeight: 436.586001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC1COP(=S)(O1)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC1COP(=S)(O1)O

InChI

InChI=1S/C21H41O5PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(22)24-18-20-19-25-27(23,28)26-20/h20H,2-19H2,1H3,(H,23,28)