[[4-[4-(sulfinatomethylamino)phenyl]sulfonylphenyl]amino]methanesulfinate

Systemtic Name: [[4-[4-(sulfinatomethylamino)phenyl]sulfonylphenyl]amino]methanesulfinate Openeye Name: [4-[4-(sulfinatomethylamino)phenyl]sulfonylanilino]methanesulfinate CAS Name: [4-[4-(sulfinatomethylamino)phenyl]sulfonylanilino]methanesulfinate IUPAC Name: [4-[4-(sulfinatomethylamino)phenyl]sulfonylanilino]methanesulfinate Traditional Name: [4-[4-(sulfinatomethylamino)phenyl]sulfonylanilino]methanesulfinate Formula: C14H14N2O6S3-2 MolecularWeight: 402.46576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCS(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)NCS(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCS(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)NCS(=O)[O-]

InChI

InChI=1S/C14H16N2O6S3/c17-23(18)9-15-11-1-5-13(6-2-11)25(21,22)14-7-3-12(4-8-14)16-10-24(19)20/h1-8,15-16H,9-10H2,(H,17,18)(H,19,20)/p-2