sodium 4-phenyl-1,3-thiazole-2-carboxylate hydrate

Systemtic Name: sodium 4-phenyl-1,3-thiazole-2-carboxylate hydrate Openeye Name: sodium 4-phenylthiazole-2-carboxylate hydrate CAS Name: sodium 4-phenyl-2-thiazolecarboxylate hydrate IUPAC Name: sodium 4-phenyl-1,3-thiazole-2-carboxylate hydrate Traditional Name: sodium 4-phenylthiazole-2-carboxylate hydrate Formula: C10H8NNaO3S MolecularWeight: 245.23019

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)C(=O)[O-].O.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)C(=O)[O-].O.[Na+]

InChI

InChI=1S/C10H7NO2S.Na.H2O/c12-10(13)9-11-8(6-14-9)7-4-2-1-3-5-7;;/h1-6H,(H,12,13);;1H2/q;+1;/p-1