3-[[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-(4-bromophenyl)-4-hydroxy-1-piperidyl]methyl]benzonitrile CAS Name: 3-[[4-(4-bromophenyl)-4-hydroxy-1-piperidinyl]methyl]benzonitrile IUPAC Name: 3-[[4-(4-bromophenyl)-4-hydroxypiperidin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-(4-bromophenyl)-4-hydroxy-piperidino]methyl]benzonitrile Formula: C19H19BrN2O MolecularWeight: 371.27096

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Br)O)CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Br)O)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H19BrN2O/c20-18-6-4-17(5-7-18)19(23)8-10-22(11-9-19)14-16-3-1-2-15(12-16)13-21/h1-7,12,23H,8-11,14H2