2-[4-[(3R)-3-phenylbutyl]piperazin-4-ium-1-yl]pyrimidine

Systemtic Name: 2-[4-[(3R)-3-phenylbutyl]piperazin-4-ium-1-yl]pyrimidine Openeye Name: 2-[4-[(3R)-3-phenylbutyl]piperazin-4-ium-1-yl]pyrimidine CAS Name: 2-[4-[(3R)-3-phenylbutyl]-1-piperazin-4-iumyl]pyrimidine IUPAC Name: 2-[4-[(3R)-3-phenylbutyl]piperazin-4-ium-1-yl]pyrimidine Traditional Name: 2-[4-[(3R)-3-phenylbutyl]piperazin-4-ium-1-yl]pyrimidine Formula: C18H25N4+ MolecularWeight: 297.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC[NH+]1CCN(CC1)C2=NC=CC=N2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CC[NH+]1CCN(CC1)C2=NC=CC=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H24N4/c1-16(17-6-3-2-4-7-17)8-11-21-12-14-22(15-13-21)18-19-9-5-10-20-18/h2-7,9-10,16H,8,11-15H2,1H3/p+1/t16-/m1/s1