4-[2-(1H-imidazol-5-yl)ethylamino]benzenesulfonic acid

Systemtic Name: 4-[2-(1H-imidazol-5-yl)ethylamino]benzenesulfonic acid Openeye Name: 4-[2-(1H-imidazol-5-yl)ethylamino]benzenesulfonic acid CAS Name: 4-[2-(1H-imidazol-5-yl)ethylamino]benzenesulfonic acid IUPAC Name: 4-[2-(1H-imidazol-5-yl)ethylamino]benzenesulfonic acid Traditional Name: 4-[2-(1H-imidazol-5-yl)ethylamino]besylic acid Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCC2=CN=CN2)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1NCCC2=CN=CN2)S(=O)(=O)O

InChI

InChI=1S/C11H13N3O3S/c15-18(16,17)11-3-1-9(2-4-11)13-6-5-10-7-12-8-14-10/h1-4,7-8,13H,5-6H2,(H,12,14)(H,15,16,17)