aniline; 3-(sulfonylamino)benzenesulfonic acid

Systemtic Name: aniline; 3-(sulfonylamino)benzenesulfonic acid Openeye Name: aniline; 3-(sulfonylamino)benzenesulfonic acid CAS Name: aniline; 3-(sulfonylamino)benzenesulfonic acid IUPAC Name: aniline; 3-(sulfonylamino)benzenesulfonic acid Traditional Name: phenylamine; 3-(sulfonylamino)besylic acid Formula: C12H12N2O5S2 MolecularWeight: 328.36408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N.C1=CC(=CC(=C1)S(=O)(=O)O)N=S(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)N.C1=CC(=CC(=C1)S(=O)(=O)O)N=S(=O)=O

InChI

InChI=1S/C6H5NO5S2.C6H7N/c8-13(9)7-5-2-1-3-6(4-5)14(10,11)12;7-6-4-2-1-3-5-6/h1-4H,(H,10,11,12);1-5H,7H2