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3-[(phenylmethyl)amino]benzenesulfonic acid

3-[(phenylmethyl)amino]benzenesulfonic acid

Systemtic Name:3-[(phenylmethyl)amino]benzenesulfonic acid
Openeye Name:3-(benzylamino)benzenesulfonic acid
CAS Name:3-[(phenylmethyl)amino]benzenesulfonic acid
IUPAC Name:3-(benzylamino)benzenesulfonic acid
Traditional Name:3-(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(=CC=C2)S(=O)(=O)O


Isomeric SMILES

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


InChI

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


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