ethyl 2-(3,4-dimethylphenyl)sulfonyloxy-5-nitro-benzoate

Systemtic Name: ethyl 2-(3,4-dimethylphenyl)sulfonyloxy-5-nitro-benzoate Openeye Name: ethyl 2-(3,4-dimethylphenyl)sulfonyloxy-5-nitro-benzoate CAS Name: 2-(3,4-dimethylphenyl)sulfonyloxy-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-(3,4-dimethylphenyl)sulfonyloxy-5-nitrobenzoate Traditional Name: 2-(3,4-dimethylphenyl)sulfonyloxy-5-nitro-benzoic acid ethyl ester Formula: C17H17NO7S MolecularWeight: 379.38438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OS(=O)(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OS(=O)(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C17H17NO7S/c1-4-24-17(19)15-10-13(18(20)21)6-8-16(15)25-26(22,23)14-7-5-11(2)12(3)9-14/h5-10H,4H2,1-3H3