5-(azetidin-1-ylsulfonyl)-2-bromanyl-benzoic acid

Systemtic Name: 5-(azetidin-1-ylsulfonyl)-2-bromanyl-benzoic acid Openeye Name: 5-(azetidin-1-ylsulfonyl)-2-bromo-benzoic acid CAS Name: 5-(1-azetidinylsulfonyl)-2-bromobenzoic acid IUPAC Name: 5-(azetidin-1-ylsulfonyl)-2-bromobenzoic acid Traditional Name: 5-(azetidin-1-ylsulfonyl)-2-bromo-benzoic acid Formula: C10H10BrNO4S MolecularWeight: 320.1597

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1CN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C10H10BrNO4S/c11-9-3-2-7(6-8(9)10(13)14)17(15,16)12-4-1-5-12/h2-3,6H,1,4-5H2,(H,13,14)