[(2S)-1-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)oxyphenyl]propan-2-yl]azanium

Systemtic Name: [(2S)-1-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)oxyphenyl]propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)oxyphenyl]ethyl]ammonium CAS Name: [(2S)-1-[2-[(2-methyl-6-phenyl-4-pyrimidinyl)oxy]phenyl]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[2-(2-methyl-6-phenylpyrimidin-4-yl)oxyphenyl]propan-2-yl]azanium Traditional Name: [(1S)-1-methyl-2-[2-(2-methyl-6-phenyl-pyrimidin-4-yl)oxyphenyl]ethyl]ammonium Formula: C20H22N3O+ MolecularWeight: 320.40818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)OC2=CC=CC=C2CC(C)[NH3+])C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)OC2=CC=CC=C2C[C@H](C)[NH3+])C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O/c1-14(21)12-17-10-6-7-11-19(17)24-20-13-18(22-15(2)23-20)16-8-4-3-5-9-16/h3-11,13-14H,12,21H2,1-2H3/p+1/t14-/m0/s1