4-propan-2-yl-2-sulfanylidene-4,4a,5,6,7,8-hexahydro-3H-benzo[e][1,2]oxazin-2-ium-8a-carbonitrile

Systemtic Name: 4-propan-2-yl-2-sulfanylidene-4,4a,5,6,7,8-hexahydro-3H-benzo[e][1,2]oxazin-2-ium-8a-carbonitrile Openeye Name: 4-isopropyl-2-thioxo-4,4a,5,6,7,8-hexahydro-3H-benzo[e]oxazin-2-ium-8a-carbonitrile CAS Name: 4-propan-2-yl-2-sulfanylidene-4,4a,5,6,7,8-hexahydro-3H-benzo[e]oxazin-2-ium-8a-carbonitrile IUPAC Name: 4-propan-2-yl-2-sulfanylidene-4,4a,5,6,7,8-hexahydro-3H-benzo[e]oxazin-2-ium-8a-carbonitrile Traditional Name: 4-isopropyl-2-thioxo-4,4a,5,6,7,8-hexahydro-3H-benzo[e]oxazin-2-ium-8a-carbonitrile Formula: C12H19N2OS+ MolecularWeight: 239.35706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C[N+](=S)OC2(C1CCCC2)C#N

Isomeric SMILES

CC(C)C1C[N+](=S)OC2(C1CCCC2)C#N

InChI

InChI=1S/C12H19N2OS/c1-9(2)10-7-14(16)15-12(8-13)6-4-3-5-11(10)12/h9-11H,3-7H2,1-2H3/q+1