2-[(2,6-dinitrophenyl)methyl]benzenesulfonic acid

Systemtic Name: 2-[(2,6-dinitrophenyl)methyl]benzenesulfonic acid Openeye Name: 2-[(2,6-dinitrophenyl)methyl]benzenesulfonic acid CAS Name: 2-[(2,6-dinitrophenyl)methyl]benzenesulfonic acid IUPAC Name: 2-[(2,6-dinitrophenyl)methyl]benzenesulfonic acid Traditional Name: 2-(2,6-dinitrobenzyl)besylic acid Formula: C13H10N2O7S MolecularWeight: 338.2927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CC2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C13H10N2O7S/c16-14(17)11-5-3-6-12(15(18)19)10(11)8-9-4-1-2-7-13(9)23(20,21)22/h1-7H,8H2,(H,20,21,22)