4-(2-methylphenyl)-2-morpholin-4-yl-pyrimidine-5-carboxylic acid; morpholine

Systemtic Name: 4-(2-methylphenyl)-2-morpholin-4-yl-pyrimidine-5-carboxylic acid; morpholine Openeye Name: morpholine; 2-morpholino-4-(o-tolyl)pyrimidine-5-carboxylic acid CAS Name: 4-(2-methylphenyl)-2-(4-morpholinyl)-5-pyrimidinecarboxylic acid; morpholine IUPAC Name: 4-(2-methylphenyl)-2-morpholin-4-ylpyrimidine-5-carboxylic acid; morpholine Traditional Name: morpholine; 2-morpholino-4-(o-tolyl)pyrimidine-5-carboxylic acid Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=NC=C2C(=O)O)N3CCOCC3.C1COCCN1

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=NC=C2C(=O)O)N3CCOCC3.C1COCCN1

InChI

InChI=1S/C16H17N3O3.C4H9NO/c1-11-4-2-3-5-12(11)14-13(15(20)21)10-17-16(18-14)19-6-8-22-9-7-19;1-3-6-4-2-5-1/h2-5,10H,6-9H2,1H3,(H,20,21);5H,1-4H2