3-[3,3-bis(bromanyl)-2-oxidanylidene-azetidin-1-yl]-4-methyl-benzoic acid

Systemtic Name: 3-[3,3-bis(bromanyl)-2-oxidanylidene-azetidin-1-yl]-4-methyl-benzoic acid Openeye Name: 3-(3,3-dibromo-2-oxo-azetidin-1-yl)-4-methyl-benzoic acid CAS Name: 3-(3,3-dibromo-2-oxo-1-azetidinyl)-4-methylbenzoic acid IUPAC Name: 3-(3,3-dibromo-2-oxoazetidin-1-yl)-4-methylbenzoic acid Traditional Name: 3-(3,3-dibromo-2-keto-azetidin-1-yl)-4-methyl-benzoic acid Formula: C11H9Br2NO3 MolecularWeight: 363.00206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)N2CC(C2=O)(Br)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)N2CC(C2=O)(Br)Br

InChI

InChI=1S/C11H9Br2NO3/c1-6-2-3-7(9(15)16)4-8(6)14-5-11(12,13)10(14)17/h2-4H,5H2,1H3,(H,15,16)