4-[[2,6-bis(chloranyl)phenyl]methylamino]benzenesulfonic acid

Systemtic Name: 4-[[2,6-bis(chloranyl)phenyl]methylamino]benzenesulfonic acid Openeye Name: 4-[(2,6-dichlorophenyl)methylamino]benzenesulfonic acid CAS Name: 4-[(2,6-dichlorophenyl)methylamino]benzenesulfonic acid IUPAC Name: 4-[(2,6-dichlorophenyl)methylamino]benzenesulfonic acid Traditional Name: 4-[(2,6-dichlorobenzyl)amino]besylic acid Formula: C13H11Cl2NO3S MolecularWeight: 332.20234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CNC2=CC=C(C=C2)S(=O)(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CNC2=CC=C(C=C2)S(=O)(=O)O)Cl

InChI

InChI=1S/C13H11Cl2NO3S/c14-12-2-1-3-13(15)11(12)8-16-9-4-6-10(7-5-9)20(17,18)19/h1-7,16H,8H2,(H,17,18,19)