(2-ethoxyphenyl) 2-methyl-5-nitro-benzenesulfonate

Systemtic Name: (2-ethoxyphenyl) 2-methyl-5-nitro-benzenesulfonate Openeye Name: (2-ethoxyphenyl) 2-methyl-5-nitro-benzenesulfonate CAS Name: 2-methyl-5-nitrobenzenesulfonic acid (2-ethoxyphenyl) ester IUPAC Name: (2-ethoxyphenyl) 2-methyl-5-nitrobenzenesulfonate Traditional Name: 2-methyl-5-nitro-benzenesulfonic acid o-phenetyl ester Formula: C15H15NO6S MolecularWeight: 337.3477

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC1=CC=CC=C1OS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H15NO6S/c1-3-21-13-6-4-5-7-14(13)22-23(19,20)15-10-12(16(17)18)9-8-11(15)2/h4-10H,3H2,1-2H3