(2-acetyloxy-3-nonadecoxy-propoxy)-(2-pyrrolidin-1-ium-1-ylethyl)phosphinic acid

Systemtic Name: (2-acetyloxy-3-nonadecoxy-propoxy)-(2-pyrrolidin-1-ium-1-ylethyl)phosphinic acid Openeye Name: (2-acetoxy-3-nonadecoxy-propoxy)-(2-pyrrolidin-1-ium-1-ylethyl)phosphinic acid CAS Name: (2-acetyloxy-3-nonadecoxypropoxy)-[2-(1-pyrrolidin-1-iumyl)ethyl]phosphinic acid IUPAC Name: (2-acetyloxy-3-nonadecoxypropoxy)-(2-pyrrolidin-1-ium-1-ylethyl)phosphinic acid Traditional Name: (2-acetoxy-3-nonadecoxy-propoxy)-(2-pyrrolidin-1-ium-1-ylethyl)phosphinic acid Formula: C30H61NO6P+ MolecularWeight: 562.782201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCOCC(COP(=O)(CC[NH+]1CCCC1)O)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCOCC(COP(=O)(CC[NH+]1CCCC1)O)OC(=O)C

InChI

InChI=1S/C30H60NO6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25-35-27-30(37-29(2)32)28-36-38(33,34)26-24-31-22-19-20-23-31/h30H,3-28H2,1-2H3,(H,33,34)/p+1