(2-chlorophenyl)methyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium

Systemtic Name: (2-chlorophenyl)methyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium Openeye Name: (2-chlorophenyl)methyl-[(3-pyrimidin-2-yloxyphenyl)methyl]ammonium CAS Name: (2-chlorophenyl)methyl-[[3-(2-pyrimidinyloxy)phenyl]methyl]ammonium IUPAC Name: (2-chlorophenyl)methyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium Traditional Name: (2-chlorobenzyl)-[3-(2-pyrimidyloxy)benzyl]ammonium Formula: C18H17ClN3O+ MolecularWeight: 326.80008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C[NH2+]CC2=CC(=CC=C2)OC3=NC=CC=N3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C[NH2+]CC2=CC(=CC=C2)OC3=NC=CC=N3)Cl

InChI

InChI=1S/C18H16ClN3O/c19-17-8-2-1-6-15(17)13-20-12-14-5-3-7-16(11-14)23-18-21-9-4-10-22-18/h1-11,20H,12-13H2/p+1