3-(6-bromanylnaphthalen-2-yl)sulfonyl-2-methyl-propanoic acid

Systemtic Name: 3-(6-bromanylnaphthalen-2-yl)sulfonyl-2-methyl-propanoic acid Openeye Name: 3-[(6-bromo-2-naphthyl)sulfonyl]-2-methyl-propanoic acid CAS Name: 3-[(6-bromo-2-naphthalenyl)sulfonyl]-2-methylpropanoic acid IUPAC Name: 3-(6-bromonaphthalen-2-yl)sulfonyl-2-methylpropanoic acid Traditional Name: 3-[(6-bromo-2-naphthyl)sulfonyl]-2-methyl-propionic acid Formula: C14H13BrO4S MolecularWeight: 357.21962

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)Br)C(=O)O

Isomeric SMILES

CC(CS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C14H13BrO4S/c1-9(14(16)17)8-20(18,19)13-5-3-10-6-12(15)4-2-11(10)7-13/h2-7,9H,8H2,1H3,(H,16,17)