4-[4-(4-chlorophenyl)-4-phenylmethoxy-piperidin-3-yl]carbonylbenzoic acid

Systemtic Name: 4-[4-(4-chlorophenyl)-4-phenylmethoxy-piperidin-3-yl]carbonylbenzoic acid Openeye Name: 4-[4-benzyloxy-4-(4-chlorophenyl)piperidine-3-carbonyl]benzoic acid CAS Name: 4-[[4-(4-chlorophenyl)-4-phenylmethoxy-3-piperidinyl]-oxomethyl]benzoic acid IUPAC Name: 4-[4-(4-chlorophenyl)-4-phenylmethoxypiperidine-3-carbonyl]benzoic acid Traditional Name: 4-[4-benzoxy-4-(4-chlorophenyl)nipecotoyl]benzoic acid Formula: C26H24ClNO4 MolecularWeight: 449.92606

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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(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C26H24ClNO4/c27-22-12-10-21(11-13-22)26(32-17-18-4-2-1-3-5-18)14-15-28-16-23(26)24(29)19-6-8-20(9-7-19)25(30)31/h1-13,23,28H,14-17H2,(H,30,31)