(2R)-N-[(3-fluorophenyl)methyl]-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-[(3-fluorophenyl)methyl]-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-[(3-fluorophenyl)methyl]-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-[(3-fluorophenyl)methyl]-N-methyl-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-[(3-fluorophenyl)methyl]-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-(3-fluorobenzyl)-N-methyl-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]propionamide Formula: C19H25FN5O+ MolecularWeight: 358.433103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC(=CC=C1)F)[NH+]2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C[C@H](C(=O)N(C)CC1=CC(=CC=C1)F)[NH+]2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C19H24FN5O/c1-15(18(26)23(2)14-16-5-3-6-17(20)13-16)24-9-11-25(12-10-24)19-21-7-4-8-22-19/h3-8,13,15H,9-12,14H2,1-2H3/p+1/t15-/m1/s1