N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-pyrazin-2-yl-propanamide

Systemtic Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-pyrazin-2-yl-propanamide Openeye Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-pyrazin-2-yl-propanamide CAS Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-N-methyl-3-(2-pyrazinyl)propanamide IUPAC Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-pyrazin-2-ylpropanamide Traditional Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-pyrazin-2-yl-propionamide Formula: C23H33N4O2+ MolecularWeight: 397.53372

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCC[NH+](C1)CCC2=CC=C(C=C2)OC)C(=O)CCC3=NC=CN=C3

Isomeric SMILES

CN(C[C@H]1CCC[NH+](C1)CCC2=CC=C(C=C2)OC)C(=O)CCC3=NC=CN=C3

InChI

InChI=1S/C23H32N4O2/c1-26(23(28)10-7-21-16-24-12-13-25-21)17-20-4-3-14-27(18-20)15-11-19-5-8-22(29-2)9-6-19/h5-6,8-9,12-13,16,20H,3-4,7,10-11,14-15,17-18H2,1-2H3/p+1/t20-/m1/s1