2-[4-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]piperazin-1-yl]pyrimidine; ethanedioate

Systemtic Name: 2-[4-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]piperazin-1-yl]pyrimidine; ethanedioate Openeye Name: 2-[4-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]piperazin-1-yl]pyrimidine; oxalate CAS Name: 2-[4-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-1-piperazinyl]pyrimidine; oxalate IUPAC Name: 2-[4-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperazin-1-yl]pyrimidine; oxalate Traditional Name: 2-[4-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]piperazino]pyrimidine; oxalate Formula: C25H25ClN4O5-2 MolecularWeight: 496.9428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=NC=CC=N4.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

C1CN(CCN1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=NC=CC=N4.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C23H25ClN4O.C2H2O4/c24-21-9-7-20(8-10-21)22(19-5-2-1-3-6-19)29-18-17-27-13-15-28(16-14-27)23-25-11-4-12-26-23;3-1(4)2(5)6/h1-12,22H,13-18H2;(H,3,4)(H,5,6)/p-2