2-(2-dimethylaminoethyloxy)-5-(4-fluoranyl-2-methyl-phenyl)pyrimidine-4-carboxylic acid

Systemtic Name: 2-(2-dimethylaminoethyloxy)-5-(4-fluoranyl-2-methyl-phenyl)pyrimidine-4-carboxylic acid Openeye Name: 2-(2-dimethylaminoethyloxy)-5-(4-fluoro-2-methyl-phenyl)pyrimidine-4-carboxylic acid CAS Name: 2-(2-dimethylaminoethyloxy)-5-(4-fluoro-2-methylphenyl)-4-pyrimidinecarboxylic acid IUPAC Name: 2-(2-dimethylaminoethyloxy)-5-(4-fluoro-2-methylphenyl)pyrimidine-4-carboxylic acid Traditional Name: 2-(2-dimethylaminoethyloxy)-5-(4-fluoro-2-methyl-phenyl)pyrimidine-4-carboxylic acid Formula: C16H18FN3O3 MolecularWeight: 319.330823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2=CN=C(N=C2C(=O)O)OCCN(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2=CN=C(N=C2C(=O)O)OCCN(C)C

InChI

InChI=1S/C16H18FN3O3/c1-10-8-11(17)4-5-12(10)13-9-18-16(19-14(13)15(21)22)23-7-6-20(2)3/h4-5,8-9H,6-7H2,1-3H3,(H,21,22)