3-[[2,6-bis(chloranyl)phenyl]methylamino]benzenesulfonic acid

Systemtic Name: 3-[[2,6-bis(chloranyl)phenyl]methylamino]benzenesulfonic acid Openeye Name: 3-[(2,6-dichlorophenyl)methylamino]benzenesulfonic acid CAS Name: 3-[(2,6-dichlorophenyl)methylamino]benzenesulfonic acid IUPAC Name: 3-[(2,6-dichlorophenyl)methylamino]benzenesulfonic acid Traditional Name: 3-[(2,6-dichlorobenzyl)amino]besylic acid Formula: C13H11Cl2NO3S MolecularWeight: 332.20234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)NCC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)NCC2=C(C=CC=C2Cl)Cl

InChI

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