3-[[4-(4-chlorophenyl)-1-ethanoyl-4-phenylmethoxy-piperidin-3-yl]oxymethyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(4-chlorophenyl)-1-ethanoyl-4-phenylmethoxy-piperidin-3-yl]oxymethyl]benzenecarbonitrile Openeye Name: 3-[[1-acetyl-4-benzyloxy-4-(4-chlorophenyl)-3-piperidyl]oxymethyl]benzonitrile CAS Name: 3-[[1-acetyl-4-(4-chlorophenyl)-4-phenylmethoxy-3-piperidinyl]oxymethyl]benzonitrile IUPAC Name: 3-[[1-acetyl-4-(4-chlorophenyl)-4-phenylmethoxypiperidin-3-yl]oxymethyl]benzonitrile Traditional Name: 3-[[1-acetyl-4-benzoxy-4-(4-chlorophenyl)-3-piperidyl]oxymethyl]benzonitrile Formula: C28H27ClN2O3 MolecularWeight: 474.97858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(C(C1)OCC2=CC=CC(=C2)C#N)(C3=CC=C(C=C3)Cl)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCC(C(C1)OCC2=CC=CC(=C2)C#N)(C3=CC=C(C=C3)Cl)OCC4=CC=CC=C4

InChI

InChI=1S/C28H27ClN2O3/c1-21(32)31-15-14-28(25-10-12-26(29)13-11-25,34-20-22-6-3-2-4-7-22)27(18-31)33-19-24-9-5-8-23(16-24)17-30/h2-13,16,27H,14-15,18-20H2,1H3