[2-butanoyloxy-3-(2,4-dimethylhexadecoxy)propoxy]-(2-dimethylaminoethyl)phosphinic acid

Systemtic Name: [2-butanoyloxy-3-(2,4-dimethylhexadecoxy)propoxy]-(2-dimethylaminoethyl)phosphinic acid Openeye Name: [2-butanoyloxy-3-(2,4-dimethylhexadecoxy)propoxy]-(2-dimethylaminoethyl)phosphinic acid CAS Name: 2-dimethylaminoethyl-[3-(2,4-dimethylhexadecoxy)-2-(1-oxobutoxy)propoxy]phosphinic acid IUPAC Name: [2-butanoyloxy-3-(2,4-dimethylhexadecoxy)propoxy]-(2-dimethylaminoethyl)phosphinic acid Traditional Name: [2-butyryloxy-3-(2,4-dimethylhexadecoxy)propoxy]-(2-dimethylaminoethyl)phosphinic acid Formula: C29H60NO6P MolecularWeight: 549.763561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)CC(C)COCC(COP(=O)(CCN(C)C)O)OC(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCC(C)CC(C)COCC(COP(=O)(CCN(C)C)O)OC(=O)CCC

InChI

InChI=1S/C29H60NO6P/c1-7-9-10-11-12-13-14-15-16-17-19-26(3)22-27(4)23-34-24-28(36-29(31)18-8-2)25-35-37(32,33)21-20-30(5)6/h26-28H,7-25H2,1-6H3,(H,32,33)