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

Systemtic Name: 4-[4-(4-chlorophenyl)-4-phenylmethoxy-piperidin-3-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-benzyloxy-4-(4-chlorophenyl)piperidine-3-carbonyl]benzonitrile CAS Name: 4-[[4-(4-chlorophenyl)-4-phenylmethoxy-3-piperidinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-(4-chlorophenyl)-4-phenylmethoxypiperidine-3-carbonyl]benzonitrile Traditional Name: 4-[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=C(C=C4)C#N

Isomeric SMILES

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

InChI

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