3-(2-azanyl-2-oxidanylidene-ethyl)sulfonyl-4-bromanyl-benzoic acid

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfonyl-4-bromanyl-benzoic acid Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfonyl-4-bromo-benzoic acid CAS Name: 3-(2-amino-2-oxoethyl)sulfonyl-4-bromobenzoic acid IUPAC Name: 3-(2-amino-2-oxoethyl)sulfonyl-4-bromobenzoic acid Traditional Name: 3-(2-amino-2-keto-ethyl)sulfonyl-4-bromo-benzoic acid Formula: C9H8BrNO5S MolecularWeight: 322.13252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)CC(=O)N)Br

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)CC(=O)N)Br

InChI

InChI=1S/C9H8BrNO5S/c10-6-2-1-5(9(13)14)3-7(6)17(15,16)4-8(11)12/h1-3H,4H2,(H2,11,12)(H,13,14)