7,11-dicyano-3-ethyl-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 1-methylpiperidin-1-ium

Systemtic Name: 7,11-dicyano-3-ethyl-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 1-methylpiperidin-1-ium Openeye Name: 7,11-dicyano-3-ethyl-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 1-methylpiperidin-1-ium CAS Name: 7,11-dicyano-3-ethyl-10-mercapto-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 1-methylpiperidin-1-ium IUPAC Name: 7,11-dicyano-3-ethyl-10-sulfanyl-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 1-methylpiperidin-1-ium Traditional Name: 7,11-dicyano-3-ethyl-10-mercapto-9-azaspiro[5.5]undeca-8,10-dien-8-olate; 1-methylpiperidin-1-ium Formula: C20H30N4OS MolecularWeight: 374.5434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2(CC1)C(C(=NC(=C2C#N)S)[O-])C#N.C[NH+]1CCCCC1

Isomeric SMILES

CCC1CCC2(CC1)C(C(=NC(=C2C#N)S)[O-])C#N.C[NH+]1CCCCC1

InChI

InChI=1S/C14H17N3OS.C6H13N/c1-2-9-3-5-14(6-4-9)10(7-15)12(18)17-13(19)11(14)8-16;1-7-5-3-2-4-6-7/h9-10,19H,2-6H2,1H3,(H,17,18);2-6H2,1H3