2-[4-[(3R)-1-(furan-2-ylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-yl]pyrimidine

Systemtic Name: 2-[4-[(3R)-1-(furan-2-ylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-yl]pyrimidine Openeye Name: 2-[4-[(3R)-1-(2-furylmethyl)pyrrolidin-1-ium-3-yl]-1-piperidyl]pyrimidine CAS Name: 2-[4-[(3R)-1-(2-furanylmethyl)-3-pyrrolidin-1-iumyl]-1-piperidinyl]pyrimidine IUPAC Name: 2-[4-[(3R)-1-(furan-2-ylmethyl)pyrrolidin-1-ium-3-yl]piperidin-1-yl]pyrimidine Traditional Name: 2-[4-[(3R)-1-(2-furfuryl)pyrrolidin-1-ium-3-yl]piperidino]pyrimidine Formula: C18H25N4O+ MolecularWeight: 313.4173

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1C2CCN(CC2)C3=NC=CC=N3)CC4=CC=CO4

Isomeric SMILES

C1C[NH+](C[C@H]1C2CCN(CC2)C3=NC=CC=N3)CC4=CC=CO4

InChI

InChI=1S/C18H24N4O/c1-3-17(23-12-1)14-21-9-4-16(13-21)15-5-10-22(11-6-15)18-19-7-2-8-20-18/h1-3,7-8,12,15-16H,4-6,9-11,13-14H2/p+1/t16-/m0/s1