2-(2-methyl-5-nitro-phenyl)benzenesulfonic acid

Systemtic Name: 2-(2-methyl-5-nitro-phenyl)benzenesulfonic acid Openeye Name: 2-(2-methyl-5-nitro-phenyl)benzenesulfonic acid CAS Name: 2-(2-methyl-5-nitrophenyl)benzenesulfonic acid IUPAC Name: 2-(2-methyl-5-nitrophenyl)benzenesulfonic acid Traditional Name: 2-(2-methyl-5-nitro-phenyl)besylic acid Formula: C13H11NO5S MolecularWeight: 293.29514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C13H11NO5S/c1-9-6-7-10(14(15)16)8-12(9)11-4-2-3-5-13(11)20(17,18)19/h2-8H,1H3,(H,17,18,19)