[2-acetyloxy-3-(2-methylhexadecoxy)propoxy]-(2-pyrrolidin-1-ylethyl)phosphinic acid

Systemtic Name: [2-acetyloxy-3-(2-methylhexadecoxy)propoxy]-(2-pyrrolidin-1-ylethyl)phosphinic acid Openeye Name: [2-acetoxy-3-(2-methylhexadecoxy)propoxy]-(2-pyrrolidin-1-ylethyl)phosphinic acid CAS Name: [2-acetyloxy-3-(2-methylhexadecoxy)propoxy]-[2-(1-pyrrolidinyl)ethyl]phosphinic acid IUPAC Name: [2-acetyloxy-3-(2-methylhexadecoxy)propoxy]-(2-pyrrolidin-1-ylethyl)phosphinic acid Traditional Name: [2-acetoxy-3-(2-methylhexadecoxy)propoxy]-(2-pyrrolidinoethyl)phosphinic acid Formula: C28H56NO6P MolecularWeight: 533.721101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C)COCC(COP(=O)(CCN1CCCC1)O)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCC(C)COCC(COP(=O)(CCN1CCCC1)O)OC(=O)C

InChI

InChI=1S/C28H56NO6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-18-26(2)23-33-24-28(35-27(3)30)25-34-36(31,32)22-21-29-19-16-17-20-29/h26,28H,4-25H2,1-3H3,(H,31,32)