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

Systemtic Name: 1-[4-[(4-chlorophenyl)-phenyl-methoxy]butyl]-4-phenyl-piperazine; ethanedioic acid Openeye Name: 1-[4-[(4-chlorophenyl)-phenyl-methoxy]butyl]-4-phenyl-piperazine; oxalic acid CAS Name: 1-[4-[(4-chlorophenyl)-phenylmethoxy]butyl]-4-phenylpiperazine; oxalic acid IUPAC Name: 1-[4-[(4-chlorophenyl)-phenylmethoxy]butyl]-4-phenylpiperazine; oxalic acid Traditional Name: 1-[4-[(4-chlorophenyl)-phenyl-methoxy]butyl]-4-phenyl-piperazine; oxalic acid Formula: C29H33ClN2O5 MolecularWeight: 525.03572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31ClN2O.C2H2O4/c28-25-15-13-24(14-16-25)27(23-9-3-1-4-10-23)31-22-8-7-17-29-18-20-30(21-19-29)26-11-5-2-6-12-26;3-1(4)2(5)6/h1-6,9-16,27H,7-8,17-22H2;(H,3,4)(H,5,6)