N-[[(3R)-1-(2-azanyl-6-methoxy-pyrimidin-1-ium-4-yl)piperidin-3-yl]methyl]ethanamide

Systemtic Name: N-[[(3R)-1-(2-azanyl-6-methoxy-pyrimidin-1-ium-4-yl)piperidin-3-yl]methyl]ethanamide Openeye Name: N-[[(3R)-1-(2-amino-6-methoxy-pyrimidin-1-ium-4-yl)-3-piperidyl]methyl]acetamide CAS Name: N-[[(3R)-1-(2-amino-6-methoxy-4-pyrimidin-1-iumyl)-3-piperidinyl]methyl]acetamide IUPAC Name: N-[[(3R)-1-(2-amino-6-methoxypyrimidin-1-ium-4-yl)piperidin-3-yl]methyl]acetamide Traditional Name: N-[[(3R)-1-(2-amino-6-methoxy-pyrimidin-1-ium-4-yl)-3-piperidyl]methyl]acetamide Formula: C13H22N5O2+ MolecularWeight: 280.34608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CCCN(C1)C2=CC(=[NH+]C(=N2)N)OC

Isomeric SMILES

CC(=O)NC[C@H]1CCCN(C1)C2=CC(=[NH+]C(=N2)N)OC

InChI

InChI=1S/C13H21N5O2/c1-9(19)15-7-10-4-3-5-18(8-10)11-6-12(20-2)17-13(14)16-11/h6,10H,3-5,7-8H2,1-2H3,(H,15,19)(H2,14,16,17)/p+1/t10-/m1/s1