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2-oxidanyl-4-(1-phenylethyl)benzene-1,3-disulfonic acid

2-oxidanyl-4-(1-phenylethyl)benzene-1,3-disulfonic acid

Systemtic Name:2-oxidanyl-4-(1-phenylethyl)benzene-1,3-disulfonic acid
Openeye Name:2-hydroxy-4-(1-phenylethyl)benzene-1,3-disulfonic acid
CAS Name:2-hydroxy-4-(1-phenylethyl)benzene-1,3-disulfonic acid
IUPAC Name:2-hydroxy-4-(1-phenylethyl)benzene-1,3-disulfonic acid
Traditional Name:2-hydroxy-4-(1-phenylethyl)benzene-1,3-disulfonic acid
Formula: C14H14O7S2
MolecularWeight: 358.38676
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C14H14O7S2/c1-9(10-5-3-2-4-6-10)11-7-8-12(22(16,17)18)13(15)14(11)23(19,20)21/h2-9,15H,1H3,(H,16,17,18)(H,19,20,21)


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