(2-morpholin-4-yl-2-oxidanylidene-ethyl) 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate Openeye Name: (2-morpholino-2-oxo-ethyl) 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate CAS Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-4-pyrazolyl]propanoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 3-[1-(3-methoxyphenyl)-3,5-dimethylpyrazol-4-yl]propanoate Traditional Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propionic acid (2-keto-2-morpholino-ethyl) ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=CC=C2)OC)C)CCC(=O)OCC(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=CC=C2)OC)C)CCC(=O)OCC(=O)N3CCOCC3

InChI

InChI=1S/C21H27N3O5/c1-15-19(16(2)24(22-15)17-5-4-6-18(13-17)27-3)7-8-21(26)29-14-20(25)23-9-11-28-12-10-23/h4-6,13H,7-12,14H2,1-3H3