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

Systemtic Name: 2-[(2R)-1-[(2,3-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-[(2R)-1-[(2,3-dimethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[(2R)-1-[(2,3-dimethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-(1-methyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-[(2R)-1-[(2,3-dimethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[(2R)-3-keto-1-o-veratryl-piperazin-1-ium-2-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)acetamide Formula: C22H36N4O4+2 MolecularWeight: 420.54564

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=O)CC2C(=O)NCC[NH+]2CC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C22H34N4O4/c1-24-11-8-17(9-12-24)25(2)20(27)14-18-22(28)23-10-13-26(18)15-16-6-5-7-19(29-3)21(16)30-4/h5-7,17-18H,8-15H2,1-4H3,(H,23,28)/p+2/t18-/m1/s1