sodium 3-oxidanyl-4-sulfanyl-benzenecarbonitrile

Systemtic Name: sodium 3-oxidanyl-4-sulfanyl-benzenecarbonitrile Openeye Name: sodium 3-hydroxy-4-sulfanyl-benzonitrile CAS Name: sodium 3-hydroxy-4-mercaptobenzonitrile IUPAC Name: sodium 3-hydroxy-4-sulfanylbenzonitrile Traditional Name: sodium 3-hydroxy-4-mercapto-benzonitrile Formula: C7H5NNaOS+ MolecularWeight: 174.17547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)O)S.[Na+]

Isomeric SMILES

C1=CC(=C(C=C1C#N)O)S.[Na+]

InChI

InChI=1S/C7H5NOS.Na/c8-4-5-1-2-7(10)6(9)3-5;/h1-3,9-10H;/q;+1