sodium 4-oxidanylidene-6-phenyl-thiochromene-2-carboxylate

Systemtic Name: sodium 4-oxidanylidene-6-phenyl-thiochromene-2-carboxylate Openeye Name: sodium 4-oxo-6-phenyl-thiochromene-2-carboxylate CAS Name: sodium 4-oxo-6-phenyl-1-benzothiopyran-2-carboxylate IUPAC Name: sodium 4-oxo-6-phenylthiochromene-2-carboxylate Traditional Name: sodium 4-keto-6-phenyl-thiochromene-2-carboxylate Formula: C16H9NaO3S MolecularWeight: 304.29563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2)SC(=CC3=O)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2)SC(=CC3=O)C(=O)[O-].[Na+]

InChI

InChI=1S/C16H10O3S.Na/c17-13-9-15(16(18)19)20-14-7-6-11(8-12(13)14)10-4-2-1-3-5-10;/h1-9H,(H,18,19);/q;+1/p-1