methyl 5-(2-methyl-4-methylsulfonyl-phenoxy)-2-nitro-benzoate

Systemtic Name: methyl 5-(2-methyl-4-methylsulfonyl-phenoxy)-2-nitro-benzoate Openeye Name: methyl 5-(2-methyl-4-methylsulfonyl-phenoxy)-2-nitro-benzoate CAS Name: 5-(2-methyl-4-methylsulfonylphenoxy)-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 5-(2-methyl-4-methylsulfonylphenoxy)-2-nitrobenzoate Traditional Name: 5-(4-mesyl-2-methyl-phenoxy)-2-nitro-benzoic acid methyl ester Formula: C16H15NO7S MolecularWeight: 365.3578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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