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

Systemtic Name: 2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(3-methoxypropyl)ethanamide Openeye Name: 2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(3-methoxypropyl)acetamide CAS Name: 2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(3-methoxypropyl)acetamide IUPAC Name: 2-[(2R)-1-[(3,5-dimethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(3-methoxypropyl)acetamide Traditional Name: 2-[(2R)-1-(3,5-dimethoxybenzyl)-3-keto-piperazin-1-ium-2-yl]-N-(3-methoxypropyl)acetamide Formula: C19H30N3O5+ MolecularWeight: 380.4586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O5/c1-25-8-4-5-20-18(23)12-17-19(24)21-6-7-22(17)13-14-9-15(26-2)11-16(10-14)27-3/h9-11,17H,4-8,12-13H2,1-3H3,(H,20,23)(H,21,24)/p+1/t17-/m1/s1