7,11-dicyano-3-[(2-methylpropan-2-yl)oxycarbonyl]-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate

Systemtic Name: 7,11-dicyano-3-[(2-methylpropan-2-yl)oxycarbonyl]-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate Openeye Name: 3-tert-butoxycarbonyl-7,11-dicyano-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate CAS Name: 7,11-dicyano-10-mercapto-3-[(2-methylpropan-2-yl)oxy-oxomethyl]-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate IUPAC Name: 7,11-dicyano-3-[(2-methylpropan-2-yl)oxycarbonyl]-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate Traditional Name: 3-tert-butoxycarbonyl-7,11-dicyano-10-mercapto-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate Formula: C16H19N4O3S- MolecularWeight: 347.41206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2(CC1)C(C(=NC(=C2C#N)S)[O-])C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)C(C(=NC(=C2C#N)S)[O-])C#N

InChI

InChI=1S/C16H20N4O3S/c1-15(2,3)23-14(22)20-6-4-16(5-7-20)10(8-17)12(21)19-13(24)11(16)9-18/h10,24H,4-7H2,1-3H3,(H,19,21)/p-1