2,2-dimethylpropyl 4-nitrobenzenesulfonate

Systemtic Name: 2,2-dimethylpropyl 4-nitrobenzenesulfonate Openeye Name: 2,2-dimethylpropyl 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid neopentyl ester Formula: C11H15NO5S MolecularWeight: 273.3055

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)COS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H15NO5S/c1-11(2,3)8-17-18(15,16)10-6-4-9(5-7-10)12(13)14/h4-7H,8H2,1-3H3