(4-nitrophenyl) 2,3-dihydro-1,4-benzodioxine-6-sulfonate

Systemtic Name: (4-nitrophenyl) 2,3-dihydro-1,4-benzodioxine-6-sulfonate Openeye Name: (4-nitrophenyl) 2,3-dihydro-1,4-benzodioxine-6-sulfonate CAS Name: 2,3-dihydro-1,4-benzodioxin-6-sulfonic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2,3-dihydro-1,4-benzodioxine-6-sulfonate Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-sulfonic acid (4-nitrophenyl) ester Formula: C14H11NO7S MolecularWeight: 337.30464

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO7S/c16-15(17)10-1-3-11(4-2-10)22-23(18,19)12-5-6-13-14(9-12)21-8-7-20-13/h1-6,9H,7-8H2