2-(phenylmethyl)sulfinylbenzene-1,3-dicarboxylic acid

Systemtic Name: 2-(phenylmethyl)sulfinylbenzene-1,3-dicarboxylic acid Openeye Name: 2-benzylsulfinylbenzene-1,3-dicarboxylic acid CAS Name: 2-(phenylmethyl)sulfinylbenzene-1,3-dicarboxylic acid IUPAC Name: 2-benzylsulfinylbenzene-1,3-dicarboxylic acid Traditional Name: 2-benzylsulfinylisophthalic acid Formula: C15H12O5S MolecularWeight: 304.31778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)C2=C(C=CC=C2C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)C2=C(C=CC=C2C(=O)O)C(=O)O

InChI

InChI=1S/C15H12O5S/c16-14(17)11-7-4-8-12(15(18)19)13(11)21(20)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,16,17)(H,18,19)