pyridin-2-yl 2-methyl-5-nitro-benzenesulfonate

Systemtic Name: pyridin-2-yl 2-methyl-5-nitro-benzenesulfonate Openeye Name: 2-pyridyl 2-methyl-5-nitro-benzenesulfonate CAS Name: 2-methyl-5-nitrobenzenesulfonic acid 2-pyridinyl ester IUPAC Name: pyridin-2-yl 2-methyl-5-nitrobenzenesulfonate Traditional Name: 2-methyl-5-nitro-benzenesulfonic acid 2-pyridyl ester Formula: C12H10N2O5S MolecularWeight: 294.2832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=CC=N2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=CC=N2

InChI

InChI=1S/C12H10N2O5S/c1-9-5-6-10(14(15)16)8-11(9)20(17,18)19-12-4-2-3-7-13-12/h2-8H,1H3