5-azido-2-[(E)-3-oxidanylidenebut-1-enyl]benzenesulfonic acid

Systemtic Name: 5-azido-2-[(E)-3-oxidanylidenebut-1-enyl]benzenesulfonic acid Openeye Name: 5-azido-2-[(E)-3-oxobut-1-enyl]benzenesulfonic acid CAS Name: 5-azido-2-[(E)-3-oxobut-1-enyl]benzenesulfonic acid IUPAC Name: 5-azido-2-[(E)-3-oxobut-1-enyl]benzenesulfonic acid Traditional Name: 5-azido-2-[(E)-3-ketobut-1-enyl]besylic acid Formula: C10H9N3O4S MolecularWeight: 267.26116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=C(C=C(C=C1)N=[N+]=[N-])S(=O)(=O)O

Isomeric SMILES

CC(=O)/C=C/C1=C(C=C(C=C1)N=[N+]=[N-])S(=O)(=O)O

InChI

InChI=1S/C10H9N3O4S/c1-7(14)2-3-8-4-5-9(12-13-11)6-10(8)18(15,16)17/h2-6H,1H3,(H,15,16,17)/b3-2+