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

Systemtic Name: azane; (2-oxidanyl-2-sulfanylidene-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl octadecanoate Openeye Name: ammonia; (2-hydroxy-2-thioxo-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl octadecanoate CAS Name: ammonia; octadecanoic acid (2-hydroxy-2-sulfanylidene-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl ester IUPAC Name: azane; (2-hydroxy-2-sulfanylidene-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl octadecanoate Traditional Name: ammonia; stearic acid (2-hydroxy-2-thioxo-1,3,2$l^{5}-dioxaphospholan-4-yl)methyl ester Formula: C21H44NO5PS MolecularWeight: 453.616521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H41O5PS.H3N/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);1H3