2-[4-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]carbonylpiperazin-1-ium-1-yl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[4-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]carbonylpiperazin-1-ium-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[4-[4-[(4-chlorophenyl)methoxy]-3-methoxy-benzoyl]piperazin-1-ium-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[4-[[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-oxomethyl]-1-piperazin-1-iumyl]-N,N-diethylacetamide IUPAC Name: 2-[4-[4-[(4-chlorophenyl)methoxy]-3-methoxybenzoyl]piperazin-1-ium-1-yl]-N,N-diethylacetamide Traditional Name: 2-[4-[4-(4-chlorobenzyl)oxy-3-methoxy-benzoyl]piperazin-1-ium-1-yl]-N,N-diethyl-acetamide Formula: C25H33ClN3O4+ MolecularWeight: 475.00022

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C25H32ClN3O4/c1-4-28(5-2)24(30)17-27-12-14-29(15-13-27)25(31)20-8-11-22(23(16-20)32-3)33-18-19-6-9-21(26)10-7-19/h6-11,16H,4-5,12-15,17-18H2,1-3H3/p+1