2-[(7-bromanyl-2H-chromen-3-yl)sulfonyl]propanoic acid

Systemtic Name: 2-[(7-bromanyl-2H-chromen-3-yl)sulfonyl]propanoic acid Openeye Name: 2-[(7-bromo-2H-chromen-3-yl)sulfonyl]propanoic acid CAS Name: 2-[(7-bromo-2H-1-benzopyran-3-yl)sulfonyl]propanoic acid IUPAC Name: 2-[(7-bromo-2H-chromen-3-yl)sulfonyl]propanoic acid Traditional Name: 2-[(7-bromo-2H-chromen-3-yl)sulfonyl]propionic acid Formula: C12H11BrO5S MolecularWeight: 347.18174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S(=O)(=O)C1=CC2=C(C=C(C=C2)Br)OC1

Isomeric SMILES

CC(C(=O)O)S(=O)(=O)C1=CC2=C(C=C(C=C2)Br)OC1

InChI

InChI=1S/C12H11BrO5S/c1-7(12(14)15)19(16,17)10-4-8-2-3-9(13)5-11(8)18-6-10/h2-5,7H,6H2,1H3,(H,14,15)