1-[2,4,5-tris(oxidanyl)thian-3-yl]oxy-2H-naphthalene-1-carbonitrile

Systemtic Name: 1-[2,4,5-tris(oxidanyl)thian-3-yl]oxy-2H-naphthalene-1-carbonitrile Openeye Name: 1-(2,4,5-trihydroxytetrahydrothiopyran-3-yl)oxy-2H-naphthalene-1-carbonitrile CAS Name: 1-[(2,4,5-trihydroxy-3-thianyl)oxy]-2H-naphthalene-1-carbonitrile IUPAC Name: 1-(2,4,5-trihydroxythian-3-yl)oxy-2H-naphthalene-1-carbonitrile Traditional Name: 1-(2,4,5-trihydroxytetrahydrothiopyran-3-yl)oxy-2H-naphthalene-1-carbonitrile Formula: C16H17NO4S MolecularWeight: 319.37548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2=CC=CC=C2C1(C#N)OC3C(C(CSC3O)O)O

Isomeric SMILES

C1C=CC2=CC=CC=C2C1(C#N)OC3C(C(CSC3O)O)O

InChI

InChI=1S/C16H17NO4S/c17-9-16(7-3-5-10-4-1-2-6-11(10)16)21-14-13(19)12(18)8-22-15(14)20/h1-6,12-15,18-20H,7-8H2