(2-propan-2-ylphenyl) 2-methoxy-4-nitro-benzenesulfonate

Systemtic Name: (2-propan-2-ylphenyl) 2-methoxy-4-nitro-benzenesulfonate Openeye Name: (2-isopropylphenyl) 2-methoxy-4-nitro-benzenesulfonate CAS Name: 2-methoxy-4-nitrobenzenesulfonic acid (2-propan-2-ylphenyl) ester IUPAC Name: (2-propan-2-ylphenyl) 2-methoxy-4-nitrobenzenesulfonate Traditional Name: 2-methoxy-4-nitro-benzenesulfonic acid o-cumenyl ester Formula: C16H17NO6S MolecularWeight: 351.37428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)C1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H17NO6S/c1-11(2)13-6-4-5-7-14(13)23-24(20,21)16-9-8-12(17(18)19)10-15(16)22-3/h4-11H,1-3H3