5-phenylmethoxysulfonylbenzene-1,3-dicarboxylic acid

Systemtic Name: 5-phenylmethoxysulfonylbenzene-1,3-dicarboxylic acid Openeye Name: 5-benzyloxysulfonylbenzene-1,3-dicarboxylic acid CAS Name: 5-phenylmethoxysulfonylbenzene-1,3-dicarboxylic acid IUPAC Name: 5-phenylmethoxysulfonylbenzene-1,3-dicarboxylic acid Traditional Name: 5-benzoxysulfonylisophthalic acid Formula: C15H12O7S MolecularWeight: 336.31658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12O7S/c16-14(17)11-6-12(15(18)19)8-13(7-11)23(20,21)22-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)(H,18,19)