4-(3-bromophenyl)oxane-4-carbonitrile

Systemtic Name: 4-(3-bromophenyl)oxane-4-carbonitrile Openeye Name: 4-(3-bromophenyl)tetrahydropyran-4-carbonitrile CAS Name: 4-(3-bromophenyl)-4-oxanecarbonitrile IUPAC Name: 4-(3-bromophenyl)oxane-4-carbonitrile Traditional Name: 4-(3-bromophenyl)tetrahydropyran-4-carbonitrile Formula: C12H12BrNO MolecularWeight: 266.13378

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C#N)C2=CC(=CC=C2)Br

Isomeric SMILES

C1COCCC1(C#N)C2=CC(=CC=C2)Br

InChI

InChI=1S/C12H12BrNO/c13-11-3-1-2-10(8-11)12(9-14)4-6-15-7-5-12/h1-3,8H,4-7H2