2-[4,7-bis(oxidanyl)-5-phenyl-1,3-benzodithiol-2-ylidene]propanedinitrile

Systemtic Name: 2-[4,7-bis(oxidanyl)-5-phenyl-1,3-benzodithiol-2-ylidene]propanedinitrile Openeye Name: 2-(4,7-dihydroxy-5-phenyl-1,3-benzodithiol-2-ylidene)propanedinitrile CAS Name: 2-(4,7-dihydroxy-5-phenyl-1,3-benzodithiol-2-ylidene)propanedinitrile IUPAC Name: 2-(4,7-dihydroxy-5-phenyl-1,3-benzodithiol-2-ylidene)propanedinitrile Traditional Name: 2-(4,7-dihydroxy-5-phenyl-1,3-benzodithiol-2-ylidene)malononitrile Formula: C16H8N2O2S2 MolecularWeight: 324.37692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C3C(=C2O)SC(=C(C#N)C#N)S3)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C3C(=C2O)SC(=C(C#N)C#N)S3)O

InChI

InChI=1S/C16H8N2O2S2/c17-7-10(8-18)16-21-14-12(19)6-11(13(20)15(14)22-16)9-4-2-1-3-5-9/h1-6,19-20H