6-(4-bromophenyl)-3,7-dioxaspiro[3.3]heptane-6-carbonitrile

Systemtic Name: 6-(4-bromophenyl)-3,7-dioxaspiro[3.3]heptane-6-carbonitrile Openeye Name: 6-(4-bromophenyl)-3,7-dioxaspiro[3.3]heptane-6-carbonitrile CAS Name: 6-(4-bromophenyl)-3,7-dioxaspiro[3.3]heptane-6-carbonitrile IUPAC Name: 6-(4-bromophenyl)-3,7-dioxaspiro[3.3]heptane-6-carbonitrile Traditional Name: 6-(4-bromophenyl)-3,7-dioxaspiro[3.3]heptane-6-carbonitrile Formula: C12H10BrNO2 MolecularWeight: 280.1173

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Descriptors Computed from Structure

Canonical SMILES:

C1COC12CC(O2)(C#N)C3=CC=C(C=C3)Br

Isomeric SMILES

C1COC12CC(O2)(C#N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C12H10BrNO2/c13-10-3-1-9(2-4-10)11(8-14)7-12(16-11)5-6-15-12/h1-4H,5-7H2