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

Systemtic Name: 2-[(2R)-1-[(2,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-methyl-1-oxidanyl-propan-2-yl)ethanamide Openeye Name: 2-[(2R)-1-[(2,4-dimethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(2-hydroxy-1,1-dimethyl-ethyl)acetamide CAS Name: 2-[(2R)-1-[(2,4-dimethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(1-hydroxy-2-methylpropan-2-yl)acetamide IUPAC Name: 2-[(2R)-1-[(2,4-dimethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(1-hydroxy-2-methylpropan-2-yl)acetamide Traditional Name: 2-[(2R)-1-(2,4-dimethoxybenzyl)-3-keto-piperazin-1-ium-2-yl]-N-(2-hydroxy-1,1-dimethyl-ethyl)acetamide Formula: C19H30N3O5+ MolecularWeight: 380.4586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O5/c1-19(2,12-23)21-17(24)10-15-18(25)20-7-8-22(15)11-13-5-6-14(26-3)9-16(13)27-4/h5-6,9,15,23H,7-8,10-12H2,1-4H3,(H,20,25)(H,21,24)/p+1/t15-/m1/s1