4-[[4-[[(E)-3-iodanylprop-2-enoxy]methyl]piperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[[(E)-3-iodanylprop-2-enoxy]methyl]piperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[[(E)-3-iodoallyloxy]methyl]-1-piperidyl]methyl]benzonitrile CAS Name: 4-[[4-[[(E)-3-iodoprop-2-enoxy]methyl]-1-piperidinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[[(E)-3-iodoprop-2-enoxy]methyl]piperidin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[[(E)-3-iodoallyloxy]methyl]piperidino]methyl]benzonitrile Formula: C17H21IN2O MolecularWeight: 396.26591

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COCC=CI)CC2=CC=C(C=C2)C#N

Isomeric SMILES

C1CN(CCC1COC/C=C/I)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H21IN2O/c18-8-1-11-21-14-17-6-9-20(10-7-17)13-16-4-2-15(12-19)3-5-16/h1-5,8,17H,6-7,9-11,13-14H2/b8-1+