4,6-bis(azanyl)benzene-1,3-disulfonate; triethylazanium

Systemtic Name: 4,6-bis(azanyl)benzene-1,3-disulfonate; triethylazanium Openeye Name: 4,6-diaminobenzene-1,3-disulfonate; triethylammonium CAS Name: 4,6-diaminobenzene-1,3-disulfonate; triethylammonium IUPAC Name: 4,6-diaminobenzene-1,3-disulfonate; triethylazanium Traditional Name: 4,6-diaminobenzene-1,3-disulfonate; triethylammonium Formula: C18H38N4O6S2 MolecularWeight: 470.64752

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC.CC[NH+](CC)CC.C1=C(C(=CC(=C1N)S(=O)(=O)[O-])S(=O)(=O)[O-])N

Isomeric SMILES

CC[NH+](CC)CC.CC[NH+](CC)CC.C1=C(C(=CC(=C1N)S(=O)(=O)[O-])S(=O)(=O)[O-])N

InChI

InChI=1S/C6H8N2O6S2.2C6H15N/c7-3-1-4(8)6(16(12,13)14)2-5(3)15(9,10)11;2*1-4-7(5-2)6-3/h1-2H,7-8H2,(H,9,10,11)(H,12,13,14);2*4-6H2,1-3H3