[3-bromanyl-5-methoxy-4-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-phenyl]methylazanium

Systemtic Name: [3-bromanyl-5-methoxy-4-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-phenyl]methylazanium Openeye Name: [3-bromo-5-methoxy-4-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-phenyl]methylammonium CAS Name: [3-bromo-5-methoxy-4-[(2-methyl-6-phenyl-4-pyrimidinyl)oxy]phenyl]methylammonium IUPAC Name: [3-bromo-5-methoxy-4-(2-methyl-6-phenylpyrimidin-4-yl)oxyphenyl]methylazanium Traditional Name: [3-bromo-5-methoxy-4-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-benzyl]ammonium Formula: C19H19BrN3O2+ MolecularWeight: 401.27706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)OC2=C(C=C(C=C2Br)C[NH3+])OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)OC2=C(C=C(C=C2Br)C[NH3+])OC)C3=CC=CC=C3

InChI

InChI=1S/C19H18BrN3O2/c1-12-22-16(14-6-4-3-5-7-14)10-18(23-12)25-19-15(20)8-13(11-21)9-17(19)24-2/h3-10H,11,21H2,1-2H3/p+1