(4-methoxy-2,5-dimethyl-phenyl)methyl-[(1R)-1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]azanium

Systemtic Name: (4-methoxy-2,5-dimethyl-phenyl)methyl-[(1R)-1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]azanium Openeye Name: (4-methoxy-2,5-dimethyl-phenyl)methyl-[(1R)-1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]ammonium CAS Name: (4-methoxy-2,5-dimethylphenyl)methyl-[(1R)-1-(4-methyl-2-pyridin-4-yl-5-pyrimidinyl)ethyl]ammonium IUPAC Name: (4-methoxy-2,5-dimethylphenyl)methyl-[(1R)-1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]azanium Traditional Name: (4-methoxy-2,5-dimethyl-benzyl)-[(1R)-1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]ammonium Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH2+]C(C)C2=CN=C(N=C2C)C3=CC=NC=C3)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH2+][C@H](C)C2=CN=C(N=C2C)C3=CC=NC=C3)C)OC

InChI

InChI=1S/C22H26N4O/c1-14-11-21(27-5)15(2)10-19(14)12-24-16(3)20-13-25-22(26-17(20)4)18-6-8-23-9-7-18/h6-11,13,16,24H,12H2,1-5H3/p+1/t16-/m1/s1