1,4-dimethyl-1-oxidanidyl-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazin-1-ium-2-one

Systemtic Name: 1,4-dimethyl-1-oxidanidyl-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazin-1-ium-2-one Openeye Name: 1,4-dimethyl-1-oxido-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazin-1-ium-2-one CAS Name: 1,4-dimethyl-1-oxido-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]-2-piperazin-1-iumone IUPAC Name: 1,4-dimethyl-1-oxido-3-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]piperazin-1-ium-2-one Traditional Name: 1,4-dimethyl-1-oxido-3-[4-(3,4,5-trimethoxyphenyl)benzyl]piperazin-1-ium-2-one Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](C(=O)C1CC2=CC=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC)(C)[O-]

Isomeric SMILES

CN1CC[N+](C(=O)C1CC2=CC=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC)(C)[O-]

InChI

InChI=1S/C22H28N2O5/c1-23-10-11-24(2,26)22(25)18(23)12-15-6-8-16(9-7-15)17-13-19(27-3)21(29-5)20(14-17)28-4/h6-9,13-14,18H,10-12H2,1-5H3