[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-methyl-[(4-pyrimidin-2-yloxyphenyl)methyl]azanium

Systemtic Name: [(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-methyl-[(4-pyrimidin-2-yloxyphenyl)methyl]azanium Openeye Name: [(3S)-1-indan-2-yl-3-piperidyl]-methyl-[(4-pyrimidin-2-yloxyphenyl)methyl]ammonium CAS Name: [(3S)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidinyl]-methyl-[[4-(2-pyrimidinyloxy)phenyl]methyl]ammonium IUPAC Name: [(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-methyl-[(4-pyrimidin-2-yloxyphenyl)methyl]azanium Traditional Name: [(3S)-1-indan-2-yl-3-piperidyl]-methyl-[4-(2-pyrimidyloxy)benzyl]ammonium Formula: C26H31N4O+ MolecularWeight: 415.55054

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OC2=NC=CC=N2)C3CCCN(C3)C4CC5=CC=CC=C5C4

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OC2=NC=CC=N2)[C@H]3CCCN(C3)C4CC5=CC=CC=C5C4

InChI

InChI=1S/C26H30N4O/c1-29(18-20-9-11-25(12-10-20)31-26-27-13-5-14-28-26)23-8-4-15-30(19-23)24-16-21-6-2-3-7-22(21)17-24/h2-3,5-7,9-14,23-24H,4,8,15-19H2,1H3/p+1/t23-/m0/s1