1-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]-N-phenyl-piperazin-1-ium-1-carboxamide

Systemtic Name: 1-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]-N-phenyl-piperazin-1-ium-1-carboxamide Openeye Name: 1-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]-N-phenyl-piperazin-1-ium-1-carboxamide CAS Name: 1-[4-[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]oxyphenyl]-N-phenyl-1-piperazin-1-iumcarboxamide IUPAC Name: 1-[4-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]oxyphenyl]-N-phenylpiperazin-1-ium-1-carboxamide Traditional Name: 1-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]-N-phenyl-piperazin-1-ium-1-carboxamide Formula: C30H33ClN5O2+ MolecularWeight: 531.06832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(C2=CC=C(C=C2)OC(CCC3=CC=C(C=C3)Cl)CN4C=CN=C4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1C[N+](CCN1)(C2=CC=C(C=C2)OC(CCC3=CC=C(C=C3)Cl)CN4C=CN=C4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C30H32ClN5O2/c31-25-9-6-24(7-10-25)8-13-29(22-35-19-16-33-23-35)38-28-14-11-27(12-15-28)36(20-17-32-18-21-36)30(37)34-26-4-2-1-3-5-26/h1-7,9-12,14-16,19,23,29,32H,8,13,17-18,20-22H2/p+1