(Z)-but-2-enedioic acid; 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-4-phenyl-piperazine

Systemtic Name: (Z)-but-2-enedioic acid; 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-4-phenyl-piperazine Openeye Name: 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-4-phenyl-piperazine; maleic acid CAS Name: (Z)-2-butenedioic acid; 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-4-phenylpiperazine IUPAC Name: (Z)-but-2-enedioic acid; 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-4-phenylpiperazine Traditional Name: 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-4-phenyl-piperazine; maleic acid Formula: C29H31ClN2O5 MolecularWeight: 523.01984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCN1CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C25H27ClN2O.C4H4O4/c26-23-13-11-22(12-14-23)25(21-7-3-1-4-8-21)29-20-19-27-15-17-28(18-16-27)24-9-5-2-6-10-24;5-3(6)1-2-4(7)8/h1-14,25H,15-20H2;1-2H,(H,5,6)(H,7,8)/b;2-1-