disodium [1-(hexoxycarbonylamino)-1-(3-methoxycarbonylphenyl)propan-2-yl] phosphate

Systemtic Name: disodium [1-(hexoxycarbonylamino)-1-(3-methoxycarbonylphenyl)propan-2-yl] phosphate Openeye Name: disodium [2-(hexoxycarbonylamino)-2-(3-methoxycarbonylphenyl)-1-methyl-ethyl] phosphate CAS Name: disodium [1-[[hexoxy(oxo)methyl]amino]-1-(3-methoxycarbonylphenyl)propan-2-yl] phosphate IUPAC Name: disodium [1-(hexoxycarbonylamino)-1-(3-methoxycarbonylphenyl)propan-2-yl] phosphate Traditional Name: disodium [2-(3-carbomethoxyphenyl)-2-(hexoxycarbonylamino)-1-methyl-ethyl] phosphate Formula: C18H26NNa2O8P MolecularWeight: 461.354241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)NC(C1=CC=CC(=C1)C(=O)OC)C(C)OP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCOC(=O)NC(C1=CC=CC(=C1)C(=O)OC)C(C)OP(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C18H28NO8P.2Na/c1-4-5-6-7-11-26-18(21)19-16(13(2)27-28(22,23)24)14-9-8-10-15(12-14)17(20)25-3;;/h8-10,12-13,16H,4-7,11H2,1-3H3,(H,19,21)(H2,22,23,24);;/q;2*+1/p-2