(4-bromophenyl) 2-[(S)-(2,4-dinitrophenyl)sulfinyl]ethanoate

Systemtic Name: (4-bromophenyl) 2-[(S)-(2,4-dinitrophenyl)sulfinyl]ethanoate Openeye Name: (4-bromophenyl) 2-[(S)-(2,4-dinitrophenyl)sulfinyl]acetate CAS Name: 2-[(S)-(2,4-dinitrophenyl)sulfinyl]acetic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 2-[(S)-(2,4-dinitrophenyl)sulfinyl]acetate Traditional Name: 2-[(S)-(2,4-dinitrophenyl)sulfinyl]acetic acid (4-bromophenyl) ester Formula: C14H9BrN2O7S MolecularWeight: 429.19946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(=O)CS(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1OC(=O)C[S@](=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C14H9BrN2O7S/c15-9-1-4-11(5-2-9)24-14(18)8-25(23)13-6-3-10(16(19)20)7-12(13)17(21)22/h1-7H,8H2/t25-/m0/s1