(E)-2-(phenylcarbonyl)-3-piperidin-1-yl-but-2-enenitrile

Systemtic Name: (E)-2-(phenylcarbonyl)-3-piperidin-1-yl-but-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(1-piperidyl)but-2-enenitrile CAS Name: (E)-2-benzoyl-3-(1-piperidinyl)-2-butenenitrile IUPAC Name: (E)-2-benzoyl-3-piperidin-1-ylbut-2-enenitrile Traditional Name: (E)-2-benzoyl-3-piperidino-but-2-enenitrile Formula: C16H18N2O MolecularWeight: 254.32692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)C1=CC=CC=C1)N2CCCCC2

Isomeric SMILES

C/C(=C(/C#N)\C(=O)C1=CC=CC=C1)/N2CCCCC2

InChI

InChI=1S/C16H18N2O/c1-13(18-10-6-3-7-11-18)15(12-17)16(19)14-8-4-2-5-9-14/h2,4-5,8-9H,3,6-7,10-11H2,1H3/b15-13+