4-[4-[[(3R)-oxolan-3-yl]methyl]piperazin-4-ium-1-yl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine

Systemtic Name: 4-[4-[[(3R)-oxolan-3-yl]methyl]piperazin-4-ium-1-yl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine Openeye Name: 2-phenyl-4-[4-[[(3R)-tetrahydrofuran-3-yl]methyl]piperazin-4-ium-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine CAS Name: 4-[4-[[(3R)-3-oxolanyl]methyl]-1-piperazin-4-iumyl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine IUPAC Name: 4-[4-[[(3R)-oxolan-3-yl]methyl]piperazin-4-ium-1-yl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine Traditional Name: 2-phenyl-4-[4-[[(3R)-tetrahydrofuran-3-yl]methyl]piperazin-4-ium-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine Formula: C22H29N4O+ MolecularWeight: 365.49186

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(N=C2N3CC[NH+](CC3)CC4CCOC4)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C1)N=C(N=C2N3CC[NH+](CC3)C[C@H]4CCOC4)C5=CC=CC=C5

InChI

InChI=1S/C22H28N4O/c1-2-5-18(6-3-1)21-23-20-8-4-7-19(20)22(24-21)26-12-10-25(11-13-26)15-17-9-14-27-16-17/h1-3,5-6,17H,4,7-16H2/p+1/t17-/m1/s1