2-(5-nitropyridin-2-yl)sulfonylethyl benzoate

Systemtic Name: 2-(5-nitropyridin-2-yl)sulfonylethyl benzoate Openeye Name: 2-[(5-nitro-2-pyridyl)sulfonyl]ethyl benzoate CAS Name: benzoic acid 2-[(5-nitro-2-pyridinyl)sulfonyl]ethyl ester IUPAC Name: 2-(5-nitropyridin-2-yl)sulfonylethyl benzoate Traditional Name: benzoic acid 2-[(5-nitro-2-pyridyl)sulfonyl]ethyl ester Formula: C14H12N2O6S MolecularWeight: 336.31988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCS(=O)(=O)C2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCS(=O)(=O)C2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O6S/c17-14(11-4-2-1-3-5-11)22-8-9-23(20,21)13-7-6-12(10-15-13)16(18)19/h1-7,10H,8-9H2