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2-oxidanyl-5-(phenylmethyl)benzene-1,3-disulfonic acid

2-oxidanyl-5-(phenylmethyl)benzene-1,3-disulfonic acid

Systemtic Name:2-oxidanyl-5-(phenylmethyl)benzene-1,3-disulfonic acid
Openeye Name:5-benzyl-2-hydroxy-benzene-1,3-disulfonic acid
CAS Name:2-hydroxy-5-(phenylmethyl)benzene-1,3-disulfonic acid
IUPAC Name:5-benzyl-2-hydroxybenzene-1,3-disulfonic acid
Traditional Name:5-benzyl-2-hydroxy-benzene-1,3-disulfonic acid
Formula: C13H12O7S2
MolecularWeight: 344.36018
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=C(C(=C2)S(=O)(=O)O)O)S(=O)(=O)O


Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=C(C(=C2)S(=O)(=O)O)O)S(=O)(=O)O


InChI

InChI=1S/C13H12O7S2/c14-13-11(21(15,16)17)7-10(8-12(13)22(18,19)20)6-9-4-2-1-3-5-9/h1-5,7-8,14H,6H2,(H,15,16,17)(H,18,19,20)


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