benzaldehyde; 1-oxidanylidene-2-phenyl-ethanesulfonic acid

Systemtic Name: benzaldehyde; 1-oxidanylidene-2-phenyl-ethanesulfonic acid Openeye Name: benzaldehyde; 1-oxo-2-phenyl-ethanesulfonic acid CAS Name: benzaldehyde; 1-oxo-2-phenylethanesulfonic acid IUPAC Name: benzaldehyde; 1-oxo-2-phenylethanesulfonic acid Traditional Name: benzaldehyde; 1-keto-2-phenyl-ethanesulfonic acid Formula: C15H14O5S MolecularWeight: 306.33366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8O4S.C7H6O/c9-8(13(10,11)12)6-7-4-2-1-3-5-7;8-6-7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11,12);1-6H