(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methyl-[(4-pyrimidin-2-yloxyphenyl)methyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2(CC3=CC=CC=C3C2)C[NH2+]CC4=CC=C(C=C4)OC5=NC=CC=N5

Isomeric SMILES

C1CCN(CC1)C2(CC3=CC=CC=C3C2)C[NH2+]CC4=CC=C(C=C4)OC5=NC=CC=N5

InChI

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