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

Systemtic Name: (phenylmethyl) 2-(2,4-dinitrophenyl)sulfinylethanoate Openeye Name: benzyl 2-(2,4-dinitrophenyl)sulfinylacetate CAS Name: 2-(2,4-dinitrophenyl)sulfinylacetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2,4-dinitrophenyl)sulfinylacetate Traditional Name: 2-(2,4-dinitrophenyl)sulfinylacetic acid benzyl ester Formula: C15H12N2O7S MolecularWeight: 364.32998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N2O7S/c18-15(24-9-11-4-2-1-3-5-11)10-25(23)14-7-6-12(16(19)20)8-13(14)17(21)22/h1-8H,9-10H2