sodium 5-azido-2-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]benzenesulfonate

Systemtic Name: sodium 5-azido-2-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]benzenesulfonate Openeye Name: sodium 5-azido-2-[(E)-3-oxo-3-phenyl-prop-1-enyl]benzenesulfonate CAS Name: sodium 5-azido-2-[(E)-3-oxo-3-phenylprop-1-enyl]benzenesulfonate IUPAC Name: sodium 5-azido-2-[(E)-3-oxo-3-phenylprop-1-enyl]benzenesulfonate Traditional Name: sodium 5-azido-2-[(E)-3-keto-3-phenyl-prop-1-enyl]besylate Formula: C15H10N3NaO4S MolecularWeight: 351.31237

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C=CC2=C(C=C(C=C2)N=[N+]=[N-])S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C=C/C2=C(C=C(C=C2)N=[N+]=[N-])S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C15H11N3O4S.Na/c16-18-17-13-8-6-12(15(10-13)23(20,21)22)7-9-14(19)11-4-2-1-3-5-11;/h1-10H,(H,20,21,22);/q;+1/p-1/b9-7+;