7,11-dicyano-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 4-methylmorpholin-4-ium

Systemtic Name: 7,11-dicyano-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 4-methylmorpholin-4-ium Openeye Name: 7,11-dicyano-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 4-methylmorpholin-4-ium CAS Name: 7,11-dicyano-10-mercapto-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 4-methylmorpholin-4-ium IUPAC Name: 7,11-dicyano-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 4-methylmorpholin-4-ium Traditional Name: 7,11-dicyano-10-mercapto-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 4-methylmorpholin-4-ium Formula: C17H24N4O2S MolecularWeight: 348.46306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCOCC1.C1CCC2(CC1)C(C(=NC(=C2C#N)S)[O-])C#N

Isomeric SMILES

C[NH+]1CCOCC1.C1CCC2(CC1)C(C(=NC(=C2C#N)S)[O-])C#N

InChI

InChI=1S/C12H13N3OS.C5H11NO/c13-6-8-10(16)15-11(17)9(7-14)12(8)4-2-1-3-5-12;1-6-2-4-7-5-3-6/h8,17H,1-5H2,(H,15,16);2-5H2,1H3