4-(4-bromanylphenoxy)-5-piperidin-1-yl-benzene-1,2-dicarbonitrile

Systemtic Name: 4-(4-bromanylphenoxy)-5-piperidin-1-yl-benzene-1,2-dicarbonitrile Openeye Name: 4-(4-bromophenoxy)-5-(1-piperidyl)phthalonitrile CAS Name: 4-(4-bromophenoxy)-5-(1-piperidinyl)benzene-1,2-dicarbonitrile IUPAC Name: 4-(4-bromophenoxy)-5-piperidin-1-ylbenzene-1,2-dicarbonitrile Traditional Name: 4-(4-bromophenoxy)-5-piperidino-phthalonitrile Formula: C19H16BrN3O MolecularWeight: 382.25384

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C(=C2)C#N)C#N)OC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C(=C2)C#N)C#N)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H16BrN3O/c20-16-4-6-17(7-5-16)24-19-11-15(13-22)14(12-21)10-18(19)23-8-2-1-3-9-23/h4-7,10-11H,1-3,8-9H2