sodium 2-(1-oxidanylidene-3-sulfanylidene-benzo[de]isoquinolin-2-yl)ethanoate

Systemtic Name: sodium 2-(1-oxidanylidene-3-sulfanylidene-benzo[de]isoquinolin-2-yl)ethanoate Openeye Name: sodium 2-(1-oxo-3-thioxo-benzo[de]isoquinolin-2-yl)acetate CAS Name: sodium 2-(1-oxo-3-sulfanylidene-2-benzo[de]isoquinolinyl)acetate IUPAC Name: sodium 2-(1-oxo-3-sulfanylidenebenzo[de]isoquinolin-2-yl)acetate Traditional Name: sodium 2-(1-keto-3-thioxo-benzo[de]isoquinolin-2-yl)acetate Formula: C14H8NNaO3S MolecularWeight: 293.27299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=S)C3=CC=C2)CC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=S)C3=CC=C2)CC(=O)[O-].[Na+]

InChI

InChI=1S/C14H9NO3S.Na/c16-11(17)7-15-13(18)9-5-1-3-8-4-2-6-10(12(8)9)14(15)19;/h1-6H,7H2,(H,16,17);/q;+1/p-1