2-[4-[(3R)-1-[(5-ethylfuran-2-yl)methyl]pyrrolidin-1-ium-3-yl]piperidin-1-yl]pyrimidine

Systemtic Name: 2-[4-[(3R)-1-[(5-ethylfuran-2-yl)methyl]pyrrolidin-1-ium-3-yl]piperidin-1-yl]pyrimidine Openeye Name: 2-[4-[(3R)-1-[(5-ethyl-2-furyl)methyl]pyrrolidin-1-ium-3-yl]-1-piperidyl]pyrimidine CAS Name: 2-[4-[(3R)-1-[(5-ethyl-2-furanyl)methyl]-3-pyrrolidin-1-iumyl]-1-piperidinyl]pyrimidine IUPAC Name: 2-[4-[(3R)-1-[(5-ethylfuran-2-yl)methyl]pyrrolidin-1-ium-3-yl]piperidin-1-yl]pyrimidine Traditional Name: 2-[4-[(3R)-1-[(5-ethyl-2-furyl)methyl]pyrrolidin-1-ium-3-yl]piperidino]pyrimidine Formula: C20H29N4O+ MolecularWeight: 341.47046

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C[NH+]2CCC(C2)C3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCC1=CC=C(O1)C[NH+]2CC[C@@H](C2)C3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H28N4O/c1-2-18-4-5-19(25-18)15-23-11-6-17(14-23)16-7-12-24(13-8-16)20-21-9-3-10-22-20/h3-5,9-10,16-17H,2,6-8,11-15H2,1H3/p+1/t17-/m0/s1