(2-butanoyloxy-3-pentadecoxy-propoxy)-(2-pyrrolidin-1-ylethyl)phosphinic acid

Systemtic Name: (2-butanoyloxy-3-pentadecoxy-propoxy)-(2-pyrrolidin-1-ylethyl)phosphinic acid Openeye Name: (2-butanoyloxy-3-pentadecoxy-propoxy)-(2-pyrrolidin-1-ylethyl)phosphinic acid CAS Name: [2-(1-oxobutoxy)-3-pentadecoxypropoxy]-[2-(1-pyrrolidinyl)ethyl]phosphinic acid IUPAC Name: (2-butanoyloxy-3-pentadecoxypropoxy)-(2-pyrrolidin-1-ylethyl)phosphinic acid Traditional Name: (2-butyryloxy-3-pentadecoxy-propoxy)-(2-pyrrolidinoethyl)phosphinic acid Formula: C28H56NO6P MolecularWeight: 533.721101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOCC(COP(=O)(CCN1CCCC1)O)OC(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCOCC(COP(=O)(CCN1CCCC1)O)OC(=O)CCC

InChI

InChI=1S/C28H56NO6P/c1-3-5-6-7-8-9-10-11-12-13-14-15-18-23-33-25-27(35-28(30)19-4-2)26-34-36(31,32)24-22-29-20-16-17-21-29/h27H,3-26H2,1-2H3,(H,31,32)