(5-azanyl-2-methoxy-phenyl)-bis(2-hydroxyethyl)azanium sulfate

Systemtic Name: (5-azanyl-2-methoxy-phenyl)-bis(2-hydroxyethyl)azanium sulfate Openeye Name: (5-amino-2-methoxy-phenyl)-bis(2-hydroxyethyl)ammonium sulfate CAS Name: (5-amino-2-methoxyphenyl)-bis(2-hydroxyethyl)ammonium sulfate IUPAC Name: (5-amino-2-methoxyphenyl)-bis(2-hydroxyethyl)azanium sulfate Traditional Name: (5-amino-2-methoxy-phenyl)-bis(2-hydroxyethyl)ammonium sulfate Formula: C22H38N4O10S MolecularWeight: 550.62292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N)[NH+](CCO)CCO.COC1=C(C=C(C=C1)N)[NH+](CCO)CCO.[O-]S(=O)(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)N)[NH+](CCO)CCO.COC1=C(C=C(C=C1)N)[NH+](CCO)CCO.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C11H18N2O3.H2O4S/c2*1-16-11-3-2-9(12)8-10(11)13(4-6-14)5-7-15;1-5(2,3)4/h2*2-3,8,14-15H,4-7,12H2,1H3;(H2,1,2,3,4)