2-ethylsulfonylethyl 4-nitrobenzoate

Systemtic Name: 2-ethylsulfonylethyl 4-nitrobenzoate Openeye Name: 2-ethylsulfonylethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-ethylsulfonylethyl ester IUPAC Name: 2-ethylsulfonylethyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-esylethyl ester Formula: C11H13NO6S MolecularWeight: 287.28902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO6S/c1-2-19(16,17)8-7-18-11(13)9-3-5-10(6-4-9)12(14)15/h3-6H,2,7-8H2,1H3