(2R)-N-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-cyclohexyl-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-cyclohexyl-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]propionamide Formula: C17H28N5O+ MolecularWeight: 318.43712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)[NH+]2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)[NH+]2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C17H27N5O/c1-14(16(23)20-15-6-3-2-4-7-15)21-10-12-22(13-11-21)17-18-8-5-9-19-17/h5,8-9,14-15H,2-4,6-7,10-13H2,1H3,(H,20,23)/p+1/t14-/m1/s1