(3-carboxy-4-chloranyl-phenyl)azanium; hydrogen sulfate

Systemtic Name: (3-carboxy-4-chloranyl-phenyl)azanium; hydrogen sulfate Openeye Name: (3-carboxy-4-chloro-phenyl)ammonium; hydrogen sulfate CAS Name: (3-carboxy-4-chlorophenyl)ammonium; hydrogen sulfate IUPAC Name: (3-carboxy-4-chlorophenyl)azanium; hydrogen sulfate Traditional Name: (3-carboxy-4-chloro-phenyl)ammonium bisulfate Formula: C7H8ClNO6S MolecularWeight: 269.65952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[NH3+])C(=O)O)Cl.OS(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[NH3+])C(=O)O)Cl.OS(=O)(=O)[O-]

InChI

InChI=1S/C7H6ClNO2.H2O4S/c8-6-2-1-4(9)3-5(6)7(10)11;1-5(2,3)4/h1-3H,9H2,(H,10,11);(H2,1,2,3,4)