3-[4-methoxy-3-[1-(phenylmethyl)piperidin-4-yl]oxy-phenyl]-3-oxidanyl-propanenitrile

Systemtic Name: 3-[4-methoxy-3-[1-(phenylmethyl)piperidin-4-yl]oxy-phenyl]-3-oxidanyl-propanenitrile Openeye Name: 3-[3-[(1-benzyl-4-piperidyl)oxy]-4-methoxy-phenyl]-3-hydroxy-propanenitrile CAS Name: 3-hydroxy-3-[4-methoxy-3-[[1-(phenylmethyl)-4-piperidinyl]oxy]phenyl]propanenitrile IUPAC Name: 3-[3-(1-benzylpiperidin-4-yl)oxy-4-methoxyphenyl]-3-hydroxypropanenitrile Traditional Name: 3-[3-[(1-benzyl-4-piperidyl)oxy]-4-methoxy-phenyl]-3-hydroxy-propionitrile Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC#N)O)OC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC#N)O)OC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3/c1-26-21-8-7-18(20(25)9-12-23)15-22(21)27-19-10-13-24(14-11-19)16-17-5-3-2-4-6-17/h2-8,15,19-20,25H,9-11,13-14,16H2,1H3