2-[(2R)-1-[(2,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(2-piperidin-1-ium-1-ylethyl)ethanamide

Systemtic Name: 2-[(2R)-1-[(2,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(2-piperidin-1-ium-1-ylethyl)ethanamide Openeye Name: 2-[(2R)-1-[(2,4-dimethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-(2-piperidin-1-ium-1-ylethyl)acetamide CAS Name: 2-[(2R)-1-[(2,4-dimethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-[2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-[(2R)-1-[(2,4-dimethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-(2-piperidin-1-ium-1-ylethyl)acetamide Traditional Name: 2-[(2R)-1-(2,4-dimethoxybenzyl)-3-keto-piperazin-1-ium-2-yl]-N-methyl-N-(2-piperidin-1-ium-1-ylethyl)acetamide Formula: C23H38N4O4+2 MolecularWeight: 434.57222

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC[NH+]1CCCCC1)C(=O)CC2C(=O)NCC[NH+]2CC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CN(CC[NH+]1CCCCC1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C23H36N4O4/c1-25(13-14-26-10-5-4-6-11-26)22(28)16-20-23(29)24-9-12-27(20)17-18-7-8-19(30-2)15-21(18)31-3/h7-8,15,20H,4-6,9-14,16-17H2,1-3H3,(H,24,29)/p+2/t20-/m1/s1