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

Systemtic Name: (Z)-but-2-enedioic acid; 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-4-phenethyl-piperazine Openeye Name: 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-4-phenethyl-piperazine; maleic acid CAS Name: (Z)-2-butenedioic acid; 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-4-phenethylpiperazine IUPAC Name: (Z)-but-2-enedioic acid; 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-4-phenethylpiperazine Traditional Name: 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-4-phenethyl-piperazine; maleic acid Formula: C35H39ClN2O9 MolecularWeight: 667.14516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)CCOC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1N(CCN(C1)CCOC(C2=CC=C(C=C2)Cl)C3=CC=CC=C3)CCC4=CC=CC=C4.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C27H31ClN2O.2C4H4O4/c28-26-13-11-25(12-14-26)27(24-9-5-2-6-10-24)31-22-21-30-19-17-29(18-20-30)16-15-23-7-3-1-4-8-23;2*5-3(6)1-2-4(7)8/h1-14,27H,15-22H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-