2-[3-ethoxy-4-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-phenyl]ethylazanium

Systemtic Name: 2-[3-ethoxy-4-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-phenyl]ethylazanium Openeye Name: 2-[3-ethoxy-4-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-phenyl]ethylammonium CAS Name: 2-[3-ethoxy-4-[(2-methyl-6-phenyl-4-pyrimidinyl)oxy]phenyl]ethylammonium IUPAC Name: 2-[3-ethoxy-4-(2-methyl-6-phenylpyrimidin-4-yl)oxyphenyl]ethylazanium Traditional Name: 2-[3-ethoxy-4-(2-methyl-6-phenyl-pyrimidin-4-yl)oxy-phenyl]ethylammonium Formula: C21H24N3O2+ MolecularWeight: 350.43416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC[NH3+])OC2=NC(=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC[NH3+])OC2=NC(=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H23N3O2/c1-3-25-20-13-16(11-12-22)9-10-19(20)26-21-14-18(23-15(2)24-21)17-7-5-4-6-8-17/h4-10,13-14H,3,11-12,22H2,1-2H3/p+1