1-(5-fluoranyl-2-phenylmethoxy-phenyl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile

Systemtic Name: 1-(5-fluoranyl-2-phenylmethoxy-phenyl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile Openeye Name: 1-(2-benzyloxy-5-fluoro-phenyl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile CAS Name: 1-(5-fluoro-2-phenylmethoxyphenyl)-4-(3-methoxyphenyl)-4-piperidinecarbonitrile IUPAC Name: 1-(5-fluoro-2-phenylmethoxyphenyl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile Traditional Name: 1-(2-benzoxy-5-fluoro-phenyl)-4-(3-methoxyphenyl)isonipecotonitrile Formula: C26H25FN2O2 MolecularWeight: 416.487303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCN(CC2)C3=C(C=CC(=C3)F)OCC4=CC=CC=C4)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCN(CC2)C3=C(C=CC(=C3)F)OCC4=CC=CC=C4)C#N

InChI

InChI=1S/C26H25FN2O2/c1-30-23-9-5-8-21(16-23)26(19-28)12-14-29(15-13-26)24-17-22(27)10-11-25(24)31-18-20-6-3-2-4-7-20/h2-11,16-17H,12-15,18H2,1H3