1-[4-[(4-chlorophenyl)-phenyl-methoxy]butyl]-4-pyridin-2-yl-piperazine; ethanedioic acid

Systemtic Name: 1-[4-[(4-chlorophenyl)-phenyl-methoxy]butyl]-4-pyridin-2-yl-piperazine; ethanedioic acid Openeye Name: 1-[4-[(4-chlorophenyl)-phenyl-methoxy]butyl]-4-(2-pyridyl)piperazine; oxalic acid CAS Name: 1-[4-[(4-chlorophenyl)-phenylmethoxy]butyl]-4-(2-pyridinyl)piperazine; oxalic acid IUPAC Name: 1-[4-[(4-chlorophenyl)-phenylmethoxy]butyl]-4-pyridin-2-ylpiperazine; oxalic acid Traditional Name: 1-[4-[(4-chlorophenyl)-phenyl-methoxy]butyl]-4-(2-pyridyl)piperazine; oxalic acid Formula: C28H32ClN3O5 MolecularWeight: 526.02378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=N4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CCCCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=N4.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H30ClN3O.C2H2O4/c27-24-13-11-23(12-14-24)26(22-8-2-1-3-9-22)31-21-7-6-16-29-17-19-30(20-18-29)25-10-4-5-15-28-25;3-1(4)2(5)6/h1-5,8-15,26H,6-7,16-21H2;(H,3,4)(H,5,6)