2-[[(Z)-(5-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]ethanesulfonic acid

Systemtic Name: 2-[[(Z)-(5-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]ethanesulfonic acid Openeye Name: 2-[[(Z)-(5-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]ethanesulfonic acid CAS Name: 2-[[(Z)-(5-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]ethanesulfonic acid IUPAC Name: 2-[[(Z)-(5-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethanesulfonic acid Traditional Name: 2-[[(Z)-(5-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]ethanesulfonic acid Formula: C9H10BrNO4S MolecularWeight: 308.149

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNCCS(=O)(=O)O)C(=O)C(=C1)Br

Isomeric SMILES

C1=C/C(=C/NCCS(=O)(=O)O)/C(=O)C(=C1)Br

InChI

InChI=1S/C9H10BrNO4S/c10-8-3-1-2-7(9(8)12)6-11-4-5-16(13,14)15/h1-3,6,11H,4-5H2,(H,13,14,15)/b7-6-