3-[4-(4-chlorophenyl)-4-phenylmethoxy-piperidin-3-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-(4-chlorophenyl)-4-phenylmethoxy-piperidin-3-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-benzyloxy-4-(4-chlorophenyl)piperidine-3-carbonyl]benzonitrile CAS Name: 3-[[4-(4-chlorophenyl)-4-phenylmethoxy-3-piperidinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-(4-chlorophenyl)-4-phenylmethoxypiperidine-3-carbonyl]benzonitrile Traditional Name: 3-[4-benzoxy-4-(4-chlorophenyl)nipecotoyl]benzonitrile Formula: C26H23ClN2O2 MolecularWeight: 430.92602

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1(C2=CC=C(C=C2)Cl)OCC3=CC=CC=C3)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CNCC(C1(C2=CC=C(C=C2)Cl)OCC3=CC=CC=C3)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C26H23ClN2O2/c27-23-11-9-22(10-12-23)26(31-18-19-5-2-1-3-6-19)13-14-29-17-24(26)25(30)21-8-4-7-20(15-21)16-28/h1-12,15,24,29H,13-14,17-18H2