(4-nitrophenyl) 2-(2,4-dinitrophenyl)sulfinylethanoate

Systemtic Name: (4-nitrophenyl) 2-(2,4-dinitrophenyl)sulfinylethanoate Openeye Name: (4-nitrophenyl) 2-(2,4-dinitrophenyl)sulfinylacetate CAS Name: 2-(2,4-dinitrophenyl)sulfinylacetic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-(2,4-dinitrophenyl)sulfinylacetate Traditional Name: 2-(2,4-dinitrophenyl)sulfinylacetic acid (4-nitrophenyl) ester Formula: C14H9N3O9S MolecularWeight: 395.30096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CS(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CS(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O9S/c18-14(26-11-4-1-9(2-5-11)15(19)20)8-27(25)13-6-3-10(16(21)22)7-12(13)17(23)24/h1-7H,8H2