6-methyl-9,10,10-tris(oxidanylidene)thioxanthene-3-carbonitrile

Systemtic Name: 6-methyl-9,10,10-tris(oxidanylidene)thioxanthene-3-carbonitrile Openeye Name: 6-methyl-9,10,10-trioxo-thioxanthene-3-carbonitrile CAS Name: 6-methyl-9,10,10-trioxo-3-thioxanthenecarbonitrile IUPAC Name: 6-methyl-9,10,10-trioxothioxanthene-3-carbonitrile Traditional Name: 9,10,10-triketo-6-methyl-thioxanthene-3-carbonitrile Formula: C15H9NO3S MolecularWeight: 283.30186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C#N

InChI

InChI=1S/C15H9NO3S/c1-9-2-4-11-13(6-9)20(18,19)14-7-10(8-16)3-5-12(14)15(11)17/h2-7H,1H3