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

Systemtic Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-pyrazin-2-yl-propanamide Openeye Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-pyrazin-2-yl-propanamide CAS Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]-3-piperidin-1-iumyl]methyl]-N-methyl-3-(2-pyrazinyl)propanamide IUPAC Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-pyrazin-2-ylpropanamide Traditional Name: N-[[(3R)-1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N-methyl-3-pyrazin-2-yl-propionamide Formula: C22H30ClN4O+ MolecularWeight: 401.9528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29ClN4O/c1-26(22(28)9-8-21-15-24-11-12-25-21)16-19-3-2-13-27(17-19)14-10-18-4-6-20(23)7-5-18/h4-7,11-12,15,19H,2-3,8-10,13-14,16-17H2,1H3/p+1/t19-/m1/s1