disodium (2Z)-4-phenyl-2-[(sulfonatodiazenyl)methylidene]butanoate

Systemtic Name: disodium (2Z)-4-phenyl-2-[(sulfonatodiazenyl)methylidene]butanoate Openeye Name: disodium (2Z)-4-phenyl-2-(sulfonatoazomethylene)butanoate CAS Name: disodium (2Z)-4-phenyl-2-(sulfonatoazomethylidene)butanoate IUPAC Name: disodium (2Z)-4-phenyl-2-[(sulfonatodiazenyl)methylidene]butanoate Traditional Name: disodium (Z)-2-phenethyl-3-sulfonatoazo-acrylate Formula: C11H10N2Na2O5S MolecularWeight: 328.25204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=CN=NS(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O5S.2Na/c14-11(15)10(8-12-13-19(16,17)18)7-6-9-4-2-1-3-5-9;;/h1-5,8H,6-7H2,(H,14,15)(H,16,17,18);;/q;2*+1/p-2/b10-8-,13-12?;;