(E)-1-(4-azidophenyl)-3-oxidanylidene-prop-1-ene-2-sulfonic acid

Systemtic Name: (E)-1-(4-azidophenyl)-3-oxidanylidene-prop-1-ene-2-sulfonic acid Openeye Name: (E)-1-(4-azidophenyl)-3-oxo-prop-1-ene-2-sulfonic acid CAS Name: (E)-1-(4-azidophenyl)-3-oxo-1-propene-2-sulfonic acid IUPAC Name: (E)-1-(4-azidophenyl)-3-oxoprop-1-ene-2-sulfonic acid Traditional Name: (E)-1-(4-azidophenyl)-3-keto-prop-1-ene-2-sulfonic acid Formula: C9H7N3O4S MolecularWeight: 253.23458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C=O)S(=O)(=O)O)N=[N+]=[N-]

Isomeric SMILES

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

InChI

InChI=1S/C9H7N3O4S/c10-12-11-8-3-1-7(2-4-8)5-9(6-13)17(14,15)16/h1-6H,(H,14,15,16)/b9-5+