6-iodanyl-3,3-dimethyl-7-oxidanylidene-6-prop-2-enyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile

Systemtic Name: 6-iodanyl-3,3-dimethyl-7-oxidanylidene-6-prop-2-enyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile Openeye Name: 6-allyl-6-iodo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile CAS Name: 6-iodo-3,3-dimethyl-7-oxo-6-prop-2-enyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile IUPAC Name: 6-iodo-3,3-dimethyl-7-oxo-6-prop-2-enyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile Traditional Name: 6-allyl-6-iodo-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonitrile Formula: C11H13IN2OS MolecularWeight: 348.20319

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)(CC=C)I)C#N)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)(CC=C)I)C#N)C

InChI

InChI=1S/C11H13IN2OS/c1-4-5-11(12)8(15)14-7(6-13)10(2,3)16-9(11)14/h4,7,9H,1,5H2,2-3H3