3-chloranylsulfonyl-4-methoxy-5-nitro-benzoic acid

Systemtic Name: 3-chloranylsulfonyl-4-methoxy-5-nitro-benzoic acid Openeye Name: 3-chlorosulfonyl-4-methoxy-5-nitro-benzoic acid CAS Name: 3-chlorosulfonyl-4-methoxy-5-nitrobenzoic acid IUPAC Name: 3-chlorosulfonyl-4-methoxy-5-nitrobenzoic acid Traditional Name: 3-chlorosulfonyl-4-methoxy-5-nitro-benzoic acid Formula: C8H6ClNO7S MolecularWeight: 295.65374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1S(=O)(=O)Cl)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1S(=O)(=O)Cl)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H6ClNO7S/c1-17-7-5(10(13)14)2-4(8(11)12)3-6(7)18(9,15)16/h2-3H,1H3,(H,11,12)