1-methyl-2,3,7-trioxabicyclo[2.2.1]hept-5-ene-4-carbonitrile

Systemtic Name: 1-methyl-2,3,7-trioxabicyclo[2.2.1]hept-5-ene-4-carbonitrile Openeye Name: 1-methyl-2,3,7-trioxabicyclo[2.2.1]hept-5-ene-4-carbonitrile CAS Name: 1-methyl-2,3,7-trioxabicyclo[2.2.1]hept-5-ene-4-carbonitrile IUPAC Name: 1-methyl-2,3,7-trioxabicyclo[2.2.1]hept-5-ene-4-carbonitrile Traditional Name: 1-methyl-2,3,7-trioxabicyclo[2.2.1]hept-5-ene-4-carbonitrile Formula: C6H5NO3 MolecularWeight: 139.1088

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Descriptors Computed from Structure

Canonical SMILES:

CC12C=CC(O1)(OO2)C#N

Isomeric SMILES

CC12C=CC(O1)(OO2)C#N

InChI

InChI=1S/C6H5NO3/c1-5-2-3-6(4-7,8-5)10-9-5/h2-3H,1H3