(3-pyridin-2-yloxyphenyl) 4-methoxy-2-nitro-benzenesulfonate

Systemtic Name: (3-pyridin-2-yloxyphenyl) 4-methoxy-2-nitro-benzenesulfonate Openeye Name: [3-(2-pyridyloxy)phenyl] 4-methoxy-2-nitro-benzenesulfonate CAS Name: 4-methoxy-2-nitrobenzenesulfonic acid [3-(2-pyridinyloxy)phenyl] ester IUPAC Name: (3-pyridin-2-yloxyphenyl) 4-methoxy-2-nitrobenzenesulfonate Traditional Name: 4-methoxy-2-nitro-benzenesulfonic acid [3-(2-pyridyloxy)phenyl] ester Formula: C18H14N2O7S MolecularWeight: 402.37796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)OC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)OC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O7S/c1-25-13-8-9-17(16(12-13)20(21)22)28(23,24)27-15-6-4-5-14(11-15)26-18-7-2-3-10-19-18/h2-12H,1H3