methyl 3-(2-methyl-4-methylsulfonyl-phenoxy)-2-nitro-benzoate

Systemtic Name: methyl 3-(2-methyl-4-methylsulfonyl-phenoxy)-2-nitro-benzoate Openeye Name: methyl 3-(2-methyl-4-methylsulfonyl-phenoxy)-2-nitro-benzoate CAS Name: 3-(2-methyl-4-methylsulfonylphenoxy)-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-(2-methyl-4-methylsulfonylphenoxy)-2-nitrobenzoate Traditional Name: 3-(4-mesyl-2-methyl-phenoxy)-2-nitro-benzoic acid methyl ester Formula: C16H15NO7S MolecularWeight: 365.3578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C)OC2=CC=CC(=C2[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)C)OC2=CC=CC(=C2[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H15NO7S/c1-10-9-11(25(3,21)22)7-8-13(10)24-14-6-4-5-12(16(18)23-2)15(14)17(19)20/h4-9H,1-3H3