sodium (E)-3-(1,3-benzothiazol-2-yl)-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: sodium (E)-3-(1,3-benzothiazol-2-yl)-3-oxidanylidene-prop-1-en-1-olate Openeye Name: sodium (E)-3-(1,3-benzothiazol-2-yl)-3-oxo-prop-1-en-1-olate CAS Name: sodium (E)-3-(1,3-benzothiazol-2-yl)-3-oxo-1-propen-1-olate IUPAC Name: sodium (E)-3-(1,3-benzothiazol-2-yl)-3-oxoprop-1-en-1-olate Traditional Name: sodium (E)-3-(1,3-benzothiazol-2-yl)-3-keto-prop-1-en-1-olate Formula: C10H6NNaO2S MolecularWeight: 227.21491

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=O)C=C[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(=O)/C=C/[O-].[Na+]

InChI

InChI=1S/C10H7NO2S.Na/c12-6-5-8(13)10-11-7-3-1-2-4-9(7)14-10;/h1-6,12H;/q;+1/p-1/b6-5+;