N-methyl-2-[(2R)-3-oxidanylidene-1-propan-2-yl-piperazin-1-ium-2-yl]-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: N-methyl-2-[(2R)-3-oxidanylidene-1-propan-2-yl-piperazin-1-ium-2-yl]-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-[(2R)-1-isopropyl-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-(2-pyridylmethyl)acetamide CAS Name: N-methyl-2-[(2R)-3-oxo-1-propan-2-yl-2-piperazin-1-iumyl]-N-(2-pyridinylmethyl)acetamide IUPAC Name: N-methyl-2-[(2R)-3-oxo-1-propan-2-ylpiperazin-1-ium-2-yl]-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[(2R)-1-isopropyl-3-keto-piperazin-1-ium-2-yl]-N-methyl-N-(2-pyridylmethyl)acetamide Formula: C16H25N4O2+ MolecularWeight: 305.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCNC(=O)C1CC(=O)N(C)CC2=CC=CC=N2

Isomeric SMILES

CC(C)[NH+]1CCNC(=O)[C@H]1CC(=O)N(C)CC2=CC=CC=N2

InChI

InChI=1S/C16H24N4O2/c1-12(2)20-9-8-18-16(22)14(20)10-15(21)19(3)11-13-6-4-5-7-17-13/h4-7,12,14H,8-11H2,1-3H3,(H,18,22)/p+1/t14-/m1/s1