3-azanyl-2-[(phenylmethyl)amino]benzenesulfonic acid

Systemtic Name: 3-azanyl-2-[(phenylmethyl)amino]benzenesulfonic acid Openeye Name: 3-amino-2-(benzylamino)benzenesulfonic acid CAS Name: 3-amino-2-[(phenylmethyl)amino]benzenesulfonic acid IUPAC Name: 3-amino-2-(benzylamino)benzenesulfonic acid Traditional Name: 3-amino-2-(benzylamino)besylic acid Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=CC=C2S(=O)(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=CC=C2S(=O)(=O)O)N

InChI

InChI=1S/C13H14N2O3S/c14-11-7-4-8-12(19(16,17)18)13(11)15-9-10-5-2-1-3-6-10/h1-8,15H,9,14H2,(H,16,17,18)