2-[3-(4-methylphenyl)sulfonyl-4-oxidanylidene-chromen-7-yl]oxyethanoic acid

Systemtic Name: 2-[3-(4-methylphenyl)sulfonyl-4-oxidanylidene-chromen-7-yl]oxyethanoic acid Openeye Name: 2-[4-oxo-3-(p-tolylsulfonyl)chromen-7-yl]oxyacetic acid CAS Name: 2-[[3-(4-methylphenyl)sulfonyl-4-oxo-1-benzopyran-7-yl]oxy]acetic acid IUPAC Name: 2-[3-(4-methylphenyl)sulfonyl-4-oxochromen-7-yl]oxyacetic acid Traditional Name: 2-(4-keto-3-tosyl-chromen-7-yl)oxyacetic acid Formula: C18H14O7S MolecularWeight: 374.36456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=COC3=C(C2=O)C=CC(=C3)OCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=COC3=C(C2=O)C=CC(=C3)OCC(=O)O

InChI

InChI=1S/C18H14O7S/c1-11-2-5-13(6-3-11)26(22,23)16-9-25-15-8-12(24-10-17(19)20)4-7-14(15)18(16)21/h2-9H,10H2,1H3,(H,19,20)