N-[2-(4-chlorophenyl)ethyl]-2-[1-methyl-2,6-bis(oxidanylidene)-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-2-[1-methyl-2,6-bis(oxidanylidene)-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-2-[1-methyl-2,6-dioxo-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-2-[1-methyl-2,6-dioxo-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-2-[1-methyl-2,6-dioxo-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-2-[2,6-diketo-1-methyl-3-[4-(3,4,5-trimethoxyphenyl)benzyl]piperazin-1-ium-1-yl]acetamide Formula: C31H35ClN3O6+ MolecularWeight: 581.0791

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=O)CNC(C1=O)CC2=CC=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC)CC(=O)NCCC4=CC=C(C=C4)Cl

Isomeric SMILES

C[N+]1(C(=O)CNC(C1=O)CC2=CC=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC)CC(=O)NCCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C31H34ClN3O6/c1-35(19-28(36)33-14-13-20-7-11-24(32)12-8-20)29(37)18-34-25(31(35)38)15-21-5-9-22(10-6-21)23-16-26(39-2)30(41-4)27(17-23)40-3/h5-12,16-17,25,34H,13-15,18-19H2,1-4H3/p+1