(1S,4R,5R)-2,3-dimethyl-7-propan-2-yloxy-7-phosphabicyclo[2.2.1]hept-2-ene-5-carbonitrile

Systemtic Name: (1S,4R,5R)-2,3-dimethyl-7-propan-2-yloxy-7-phosphabicyclo[2.2.1]hept-2-ene-5-carbonitrile Openeye Name: (1S,4R,5R)-7-isopropoxy-2,3-dimethyl-7-phosphabicyclo[2.2.1]hept-2-ene-5-carbonitrile CAS Name: (1S,4R,5R)-2,3-dimethyl-7-propan-2-yloxy-7-phosphabicyclo[2.2.1]hept-2-ene-5-carbonitrile IUPAC Name: (1S,4R,5R)-2,3-dimethyl-7-propan-2-yloxy-7-phosphabicyclo[2.2.1]hept-2-ene-5-carbonitrile Traditional Name: (1S,4R,5R)-7-isopropoxy-2,3-dimethyl-7-phosphabicyclo[2.2.1]hept-2-ene-5-carbonitrile Formula: C12H18NOP MolecularWeight: 223.251181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2C(CC1P2OC(C)C)C#N)C

Isomeric SMILES

CC1=C([C@H]2[C@H](C[C@@H]1P2OC(C)C)C#N)C

InChI

InChI=1S/C12H18NOP/c1-7(2)14-15-11-5-10(6-13)12(15)9(4)8(11)3/h7,10-12H,5H2,1-4H3/t10-,11+,12+,15?/m1/s1