(3E)-1-(4-bromophenyl)-3-[methoxy(oxidanyl)methylidene]-4-oxidanylidene-cyclohexane-1-carbonitrile

Systemtic Name: (3E)-1-(4-bromophenyl)-3-[methoxy(oxidanyl)methylidene]-4-oxidanylidene-cyclohexane-1-carbonitrile Openeye Name: (3E)-1-(4-bromophenyl)-3-[hydroxy(methoxy)methylene]-4-oxo-cyclohexanecarbonitrile CAS Name: (3E)-1-(4-bromophenyl)-3-[hydroxy(methoxy)methylidene]-4-oxo-1-cyclohexanecarbonitrile IUPAC Name: (3E)-1-(4-bromophenyl)-3-[hydroxy(methoxy)methylidene]-4-oxocyclohexane-1-carbonitrile Traditional Name: (3E)-1-(4-bromophenyl)-3-[hydroxy(methoxy)methylene]-4-keto-cyclohexanecarbonitrile Formula: C15H14BrNO3 MolecularWeight: 336.18056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C1CC(CCC1=O)(C#N)C2=CC=C(C=C2)Br)O

Isomeric SMILES

CO/C(=C/1\CC(CCC1=O)(C#N)C2=CC=C(C=C2)Br)/O

InChI

InChI=1S/C15H14BrNO3/c1-20-14(19)12-8-15(9-17,7-6-13(12)18)10-2-4-11(16)5-3-10/h2-5,19H,6-8H2,1H3/b14-12+