2-azanyl-3-[[(Z)-2,3-bis(bromanyl)prop-2-enoyl]amino]benzenesulfonic acid

Systemtic Name: 2-azanyl-3-[[(Z)-2,3-bis(bromanyl)prop-2-enoyl]amino]benzenesulfonic acid Openeye Name: 2-amino-3-[[(Z)-2,3-dibromoprop-2-enoyl]amino]benzenesulfonic acid CAS Name: 2-amino-3-[[(Z)-2,3-dibromo-1-oxoprop-2-enyl]amino]benzenesulfonic acid IUPAC Name: 2-amino-3-[[(Z)-2,3-dibromoprop-2-enoyl]amino]benzenesulfonic acid Traditional Name: 2-amino-3-[[(Z)-2,3-dibromoacryloyl]amino]besylic acid Formula: C9H8Br2N2O4S MolecularWeight: 400.04382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)S(=O)(=O)O)N)NC(=O)C(=CBr)Br

Isomeric SMILES

C1=CC(=C(C(=C1)S(=O)(=O)O)N)NC(=O)/C(=C/Br)/Br

InChI

InChI=1S/C9H8Br2N2O4S/c10-4-5(11)9(14)13-6-2-1-3-7(8(6)12)18(15,16)17/h1-4H,12H2,(H,13,14)(H,15,16,17)/b5-4-