5-morpholin-4-yl-3-(4-phenoxyphenyl)pyrazole-1-carboxylic acid

Systemtic Name: 5-morpholin-4-yl-3-(4-phenoxyphenyl)pyrazole-1-carboxylic acid Openeye Name: 5-morpholino-3-(4-phenoxyphenyl)pyrazole-1-carboxylic acid CAS Name: 5-(4-morpholinyl)-3-(4-phenoxyphenyl)-1-pyrazolecarboxylic acid IUPAC Name: 5-morpholin-4-yl-3-(4-phenoxyphenyl)pyrazole-1-carboxylic acid Traditional Name: 5-morpholino-3-(4-phenoxyphenyl)pyrazole-1-carboxylic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=NN2C(=O)O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=CC(=NN2C(=O)O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C20H19N3O4/c24-20(25)23-19(22-10-12-26-13-11-22)14-18(21-23)15-6-8-17(9-7-15)27-16-4-2-1-3-5-16/h1-9,14H,10-13H2,(H,24,25)