[2-azanyl-4,6-bis(oxidanylidene)phenalen-1-yl] thiocyanate

Systemtic Name: [2-azanyl-4,6-bis(oxidanylidene)phenalen-1-yl] thiocyanate Openeye Name: (2-amino-4,6-dioxo-phenalen-1-yl) thiocyanate CAS Name: thiocyanic acid (2-amino-4,6-dioxo-1-phenalenyl) ester IUPAC Name: (2-amino-4,6-dioxophenalen-1-yl) thiocyanate Traditional Name: thiocyanic acid (2-amino-4,6-diketo-phenalen-1-yl) ester Formula: C14H8N2O2S MolecularWeight: 268.29052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C2=CC=CC3=C2C(=CC(=C3SC#N)N)C1=O

Isomeric SMILES

C1C(=O)C2=CC=CC3=C2C(=CC(=C3SC#N)N)C1=O

InChI

InChI=1S/C14H8N2O2S/c15-6-19-14-8-3-1-2-7-11(17)5-12(18)9(13(7)8)4-10(14)16/h1-4H,5,16H2