methyl 5-ethylsulfonyl-2-methoxy-4-nitro-benzoate

Systemtic Name: methyl 5-ethylsulfonyl-2-methoxy-4-nitro-benzoate Openeye Name: methyl 5-ethylsulfonyl-2-methoxy-4-nitro-benzoate CAS Name: 5-ethylsulfonyl-2-methoxy-4-nitrobenzoic acid methyl ester IUPAC Name: methyl 5-ethylsulfonyl-2-methoxy-4-nitrobenzoate Traditional Name: 5-esyl-2-methoxy-4-nitro-benzoic acid methyl ester Formula: C11H13NO7S MolecularWeight: 303.28842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C11H13NO7S/c1-4-20(16,17)10-5-7(11(13)19-3)9(18-2)6-8(10)12(14)15/h5-6H,4H2,1-3H3