4-[(phenylmethyl)amino]benzenesulfonic acid

Systemtic Name: 4-[(phenylmethyl)amino]benzenesulfonic acid Openeye Name: 4-(benzylamino)benzenesulfonic acid CAS Name: 4-[(phenylmethyl)amino]benzenesulfonic acid IUPAC Name: 4-(benzylamino)benzenesulfonic acid Traditional Name: 4-(benzylamino)besylic acid Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO3S/c15-18(16,17)13-8-6-12(7-9-13)14-10-11-4-2-1-3-5-11/h1-9,14H,10H2,(H,15,16,17)