[2,4,6-tris(bromanyl)phenyl] 2-(2,4-dinitrophenyl)sulfinylethanoate

Systemtic Name: [2,4,6-tris(bromanyl)phenyl] 2-(2,4-dinitrophenyl)sulfinylethanoate Openeye Name: (2,4,6-tribromophenyl) 2-(2,4-dinitrophenyl)sulfinylacetate CAS Name: 2-(2,4-dinitrophenyl)sulfinylacetic acid (2,4,6-tribromophenyl) ester IUPAC Name: (2,4,6-tribromophenyl) 2-(2,4-dinitrophenyl)sulfinylacetate Traditional Name: 2-(2,4-dinitrophenyl)sulfinylacetic acid (2,4,6-tribromophenyl) ester Formula: C14H7Br3N2O7S MolecularWeight: 586.99158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)CC(=O)OC2=C(C=C(C=C2Br)Br)Br

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)CC(=O)OC2=C(C=C(C=C2Br)Br)Br

InChI

InChI=1S/C14H7Br3N2O7S/c15-7-3-9(16)14(10(17)4-7)26-13(20)6-27(25)12-2-1-8(18(21)22)5-11(12)19(23)24/h1-5H,6H2