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

Systemtic Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(2-piperidin-1-ium-1-ylethyl)ethanamide Openeye Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-(2-piperidin-1-ium-1-ylethyl)acetamide CAS Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-[2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-[(2R)-1-[(3-methoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-(2-piperidin-1-ium-1-ylethyl)acetamide Traditional Name: 2-[(2R)-3-keto-1-m-anisyl-piperazin-1-ium-2-yl]-N-methyl-N-(2-piperidin-1-ium-1-ylethyl)acetamide Formula: C22H36N4O3+2 MolecularWeight: 404.54624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H34N4O3/c1-24(13-14-25-10-4-3-5-11-25)21(27)16-20-22(28)23-9-12-26(20)17-18-7-6-8-19(15-18)29-2/h6-8,15,20H,3-5,9-14,16-17H2,1-2H3,(H,23,28)/p+2/t20-/m1/s1