3-azanyl-5-nitro-4-oxidanyl-benzenesulfinic acid

Systemtic Name: 3-azanyl-5-nitro-4-oxidanyl-benzenesulfinic acid Openeye Name: 3-amino-4-hydroxy-5-nitro-benzenesulfinic acid CAS Name: 3-amino-4-hydroxy-5-nitrobenzenesulfinic acid IUPAC Name: 3-amino-4-hydroxy-5-nitrobenzenesulfinic acid Traditional Name: 3-amino-4-hydroxy-5-nitro-benzenesulfinic acid Formula: C6H6N2O5S MolecularWeight: 218.18724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])O)N)S(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])O)N)S(=O)O

InChI

InChI=1S/C6H6N2O5S/c7-4-1-3(14(12)13)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13)