2-azanyl-5-(2-chloranylethanoylamino)benzene-1,4-disulfonic acid

Systemtic Name: 2-azanyl-5-(2-chloranylethanoylamino)benzene-1,4-disulfonic acid Openeye Name: 2-amino-5-[(2-chloroacetyl)amino]benzene-1,4-disulfonic acid CAS Name: 2-amino-5-[(2-chloro-1-oxoethyl)amino]benzene-1,4-disulfonic acid IUPAC Name: 2-amino-5-[(2-chloroacetyl)amino]benzene-1,4-disulfonic acid Traditional Name: 2-amino-5-[(2-chloroacetyl)amino]benzene-1,4-disulfonic acid Formula: C8H9ClN2O7S2 MolecularWeight: 344.74926

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1S(=O)(=O)O)NC(=O)CCl)S(=O)(=O)O)N

Isomeric SMILES

C1=C(C(=CC(=C1S(=O)(=O)O)NC(=O)CCl)S(=O)(=O)O)N

InChI

InChI=1S/C8H9ClN2O7S2/c9-3-8(12)11-5-2-6(19(13,14)15)4(10)1-7(5)20(16,17)18/h1-2H,3,10H2,(H,11,12)(H,13,14,15)(H,16,17,18)