2-[5,5,10,10-tetrakis(oxidanylidene)thianthren-2-yl]propanenitrile

Systemtic Name: 2-[5,5,10,10-tetrakis(oxidanylidene)thianthren-2-yl]propanenitrile Openeye Name: 2-(5,5,10,10-tetraoxothianthren-2-yl)propanenitrile CAS Name: 2-(5,5,10,10-tetraoxo-2-thianthrenyl)propanenitrile IUPAC Name: 2-(5,5,10,10-tetraoxothianthren-2-yl)propanenitrile Traditional Name: 2-(5,5,10,10-tetraketothianthren-2-yl)propionitrile Formula: C15H11NO4S2 MolecularWeight: 333.38214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=CC2=C(C=C1)S(=O)(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CC(C#N)C1=CC2=C(C=C1)S(=O)(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C15H11NO4S2/c1-10(9-16)11-6-7-14-15(8-11)22(19,20)13-5-3-2-4-12(13)21(14,17)18/h2-8,10H,1H3