2-[3-oxidanyl-2-[1-(phenylmethyl)piperidin-4-yl]phenyl]prop-2-enenitrile

Systemtic Name: 2-[3-oxidanyl-2-[1-(phenylmethyl)piperidin-4-yl]phenyl]prop-2-enenitrile Openeye Name: 2-[2-(1-benzyl-4-piperidyl)-3-hydroxy-phenyl]prop-2-enenitrile CAS Name: 2-[3-hydroxy-2-[1-(phenylmethyl)-4-piperidinyl]phenyl]-2-propenenitrile IUPAC Name: 2-[2-(1-benzylpiperidin-4-yl)-3-hydroxyphenyl]prop-2-enenitrile Traditional Name: 2-[2-(1-benzyl-4-piperidyl)-3-hydroxy-phenyl]acrylonitrile Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C#N)C1=C(C(=CC=C1)O)C2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

C=C(C#N)C1=C(C(=CC=C1)O)C2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O/c1-16(14-22)19-8-5-9-20(24)21(19)18-10-12-23(13-11-18)15-17-6-3-2-4-7-17/h2-9,18,24H,1,10-13,15H2