1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydro-2-benzofuran-4-carbonitrile

Systemtic Name: 1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydro-2-benzofuran-4-carbonitrile Openeye Name: 1,3-dioxo-3a,4,7,7a-tetrahydroisobenzofuran-4-carbonitrile CAS Name: 1,3-dioxo-3a,4,7,7a-tetrahydroisobenzofuran-4-carbonitrile IUPAC Name: 1,3-dioxo-3a,4,7,7a-tetrahydro-2-benzofuran-4-carbonitrile Traditional Name: 1,3-diketo-3a,4,7,7a-tetrahydroisobenzofuran-4-carbonitrile Formula: C9H7NO3 MolecularWeight: 177.15678

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C2C1C(=O)OC2=O)C#N

Isomeric SMILES

C1C=CC(C2C1C(=O)OC2=O)C#N

InChI

InChI=1S/C9H7NO3/c10-4-5-2-1-3-6-7(5)9(12)13-8(6)11/h1-2,5-7H,3H2