3-oxidanylidene-2-(1H-quinolin-2-ylidene)-3-[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]propanenitrile

Systemtic Name: 3-oxidanylidene-2-(1H-quinolin-2-ylidene)-3-[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]propanenitrile Openeye Name: 3-oxo-2-(1H-quinolin-2-ylidene)-3-(9,10,10-trioxothioxanthen-3-yl)propanenitrile CAS Name: 3-oxo-2-(1H-quinolin-2-ylidene)-3-(9,10,10-trioxo-3-thioxanthenyl)propanenitrile IUPAC Name: 3-oxo-2-(1H-quinolin-2-ylidene)-3-(9,10,10-trioxothioxanthen-3-yl)propanenitrile Traditional Name: 3-keto-2-(1H-quinolin-2-ylidene)-3-(9,10,10-triketothioxanthen-3-yl)propionitrile Formula: C25H14N2O4S MolecularWeight: 438.45466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C(C#N)C(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O)N2

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C(C#N)C(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O)N2

InChI

InChI=1S/C25H14N2O4S/c26-14-19(21-12-10-15-5-1-3-7-20(15)27-21)24(28)16-9-11-18-23(13-16)32(30,31)22-8-4-2-6-17(22)25(18)29/h1-13,27H