methyl 2-morpholin-4-ylsulfonyl-6-nitro-benzoate

Systemtic Name: methyl 2-morpholin-4-ylsulfonyl-6-nitro-benzoate Openeye Name: methyl 2-morpholinosulfonyl-6-nitro-benzoate CAS Name: 2-(4-morpholinylsulfonyl)-6-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-morpholin-4-ylsulfonyl-6-nitrobenzoate Traditional Name: 2-morpholinosulfonyl-6-nitro-benzoic acid methyl ester Formula: C12H14N2O7S MolecularWeight: 330.31376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CC=C1S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O7S/c1-20-12(15)11-9(14(16)17)3-2-4-10(11)22(18,19)13-5-7-21-8-6-13/h2-4H,5-8H2,1H3