2-(4-chlorophenyl)-4-[(1-methylcyclopropyl)methoxy]-6-propyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-4-[(1-methylcyclopropyl)methoxy]-6-propyl-pyrimidine-5-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-4-[(1-methylcyclopropyl)methoxy]-6-propyl-pyrimidine-5-carboxylic acid CAS Name: 2-(4-chlorophenyl)-4-[(1-methylcyclopropyl)methoxy]-6-propyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-4-[(1-methylcyclopropyl)methoxy]-6-propylpyrimidine-5-carboxylic acid Traditional Name: 2-(4-chlorophenyl)-4-[(1-methylcyclopropyl)methoxy]-6-propyl-pyrimidine-5-carboxylic acid Formula: C19H21ClN2O3 MolecularWeight: 360.83464

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)OCC3(CC3)C)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)OCC3(CC3)C)C(=O)O

InChI

InChI=1S/C19H21ClN2O3/c1-3-4-14-15(18(23)24)17(25-11-19(2)9-10-19)22-16(21-14)12-5-7-13(20)8-6-12/h5-8H,3-4,9-11H2,1-2H3,(H,23,24)