3-[(2-chlorophenyl)methylamino]benzenesulfonic acid

Systemtic Name: 3-[(2-chlorophenyl)methylamino]benzenesulfonic acid Openeye Name: 3-[(2-chlorophenyl)methylamino]benzenesulfonic acid CAS Name: 3-[(2-chlorophenyl)methylamino]benzenesulfonic acid IUPAC Name: 3-[(2-chlorophenyl)methylamino]benzenesulfonic acid Traditional Name: 3-[(2-chlorobenzyl)amino]besylic acid Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12ClNO3S/c14-13-7-2-1-4-10(13)9-15-11-5-3-6-12(8-11)19(16,17)18/h1-8,15H,9H2,(H,16,17,18)