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2-[1-(phenylmethyl)-4,5-dihydroimidazol-2-yl]benzenesulfonic acid

2-[1-(phenylmethyl)-4,5-dihydroimidazol-2-yl]benzenesulfonic acid

Systemtic Name:2-[1-(phenylmethyl)-4,5-dihydroimidazol-2-yl]benzenesulfonic acid
Openeye Name:2-(1-benzyl-4,5-dihydroimidazol-2-yl)benzenesulfonic acid
CAS Name:2-[1-(phenylmethyl)-4,5-dihydroimidazol-2-yl]benzenesulfonic acid
IUPAC Name:2-(1-benzyl-4,5-dihydroimidazol-2-yl)benzenesulfonic acid
Traditional Name:2-(1-benzyl-2-imidazolin-2-yl)besylic acid
Formula: C16H16N2O3S
MolecularWeight: 316.37484
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=N1)C2=CC=CC=C2S(=O)(=O)O)CC3=CC=CC=C3


Isomeric SMILES

C1CN(C(=N1)C2=CC=CC=C2S(=O)(=O)O)CC3=CC=CC=C3


InChI

InChI=1S/C16H16N2O3S/c19-22(20,21)15-9-5-4-8-14(15)16-17-10-11-18(16)12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,19,20,21)


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