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

Systemtic Name: [5-bromanyl-2-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-phenyl]methylazanium Openeye Name: [5-bromo-2-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-phenyl]methylammonium CAS Name: [5-bromo-2-[(2-methyl-6-phenyl-4-pyrimidinyl)oxy]phenyl]methylammonium IUPAC Name: [5-bromo-2-(2-methyl-6-phenylpyrimidin-4-yl)oxyphenyl]methylazanium Traditional Name: [5-bromo-2-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-benzyl]ammonium Formula: C18H17BrN3O+ MolecularWeight: 371.25108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)OC2=C(C=C(C=C2)Br)C[NH3+])C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)OC2=C(C=C(C=C2)Br)C[NH3+])C3=CC=CC=C3

InChI

InChI=1S/C18H16BrN3O/c1-12-21-16(13-5-3-2-4-6-13)10-18(22-12)23-17-8-7-15(19)9-14(17)11-20/h2-10H,11,20H2,1H3/p+1