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

Systemtic Name: 2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-propan-2-yloxyethyl)ethanamide Openeye Name: 2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(2-isopropoxyethyl)acetamide CAS Name: 2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(2-propan-2-yloxyethyl)acetamide IUPAC Name: 2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(2-propan-2-yloxyethyl)acetamide Traditional Name: N-(2-isopropoxyethyl)-2-[(2R)-3-keto-1-veratryl-piperazin-1-ium-2-yl]acetamide Formula: C20H32N3O5+ MolecularWeight: 394.48518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O5/c1-14(2)28-10-8-21-19(24)12-16-20(25)22-7-9-23(16)13-15-5-6-17(26-3)18(11-15)27-4/h5-6,11,14,16H,7-10,12-13H2,1-4H3,(H,21,24)(H,22,25)/p+1/t16-/m1/s1