2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(3-propan-2-yloxypropyl)ethanamide

Systemtic Name: 2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(3-propan-2-yloxypropyl)ethanamide Openeye Name: 2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(3-isopropoxypropyl)acetamide CAS Name: 2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(3-propan-2-yloxypropyl)acetamide IUPAC Name: 2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(3-propan-2-yloxypropyl)acetamide Traditional Name: 2-[(2R)-1-(3,5-dimethoxybenzyl)-3-keto-piperazin-1-ium-2-yl]-N-(3-isopropoxypropyl)acetamide Formula: C21H34N3O5+ MolecularWeight: 408.51176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CC1C(=O)NCC[NH+]1CC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CC(C)OCCCNC(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C21H33N3O5/c1-15(2)29-9-5-6-22-20(25)13-19-21(26)23-7-8-24(19)14-16-10-17(27-3)12-18(11-16)28-4/h10-12,15,19H,5-9,13-14H2,1-4H3,(H,22,25)(H,23,26)/p+1/t19-/m1/s1