ethyl 1-(4-bromophenyl)-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-bromophenyl)-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-bromophenyl)-5-(2-morpholinoethoxy)pyrazole-4-carboxylate CAS Name: 1-(4-bromophenyl)-5-[2-(4-morpholinyl)ethoxy]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-bromophenyl)-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylate Traditional Name: 1-(4-bromophenyl)-5-(2-morpholinoethoxy)pyrazole-4-carboxylic acid ethyl ester Formula: C18H22BrN3O4 MolecularWeight: 424.28898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)Br)OCCN3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)Br)OCCN3CCOCC3

InChI

InChI=1S/C18H22BrN3O4/c1-2-25-18(23)16-13-20-22(15-5-3-14(19)4-6-15)17(16)26-12-9-21-7-10-24-11-8-21/h3-6,13H,2,7-12H2,1H3