2-[2,4-bis(azanyl)phenoxy]butane-1,4-diol sulfate

Systemtic Name: 2-[2,4-bis(azanyl)phenoxy]butane-1,4-diol sulfate Openeye Name: 2-(2,4-diaminophenoxy)butane-1,4-diol sulfate CAS Name: 2-(2,4-diaminophenoxy)butane-1,4-diol sulfate IUPAC Name: 2-(2,4-diaminophenoxy)butane-1,4-diol sulfate Traditional Name: 2-(2,4-diaminophenoxy)butane-1,4-diol sulfate Formula: C10H16N2O7S-2 MolecularWeight: 308.30824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)N)OC(CCO)CO.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1N)N)OC(CCO)CO.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C10H16N2O3.H2O4S/c11-7-1-2-10(9(12)5-7)15-8(6-14)3-4-13;1-5(2,3)4/h1-2,5,8,13-14H,3-4,6,11-12H2;(H2,1,2,3,4)/p-2