methyl 3-butan-2-yloxy-3-(furan-2-yl)-2-methoxy-2-[5-(pyridin-4-ylmethyl)-1H-pyrazol-4-yl]propanoate

Systemtic Name: methyl 3-butan-2-yloxy-3-(furan-2-yl)-2-methoxy-2-[5-(pyridin-4-ylmethyl)-1H-pyrazol-4-yl]propanoate Openeye Name: methyl 3-(2-furyl)-2-methoxy-2-[5-(4-pyridylmethyl)-1H-pyrazol-4-yl]-3-sec-butoxy-propanoate CAS Name: 3-butan-2-yloxy-3-(2-furanyl)-2-methoxy-2-[5-(pyridin-4-ylmethyl)-1H-pyrazol-4-yl]propanoic acid methyl ester IUPAC Name: methyl 3-butan-2-yloxy-3-(furan-2-yl)-2-methoxy-2-[5-(pyridin-4-ylmethyl)-1H-pyrazol-4-yl]propanoate Traditional Name: 3-(2-furyl)-2-methoxy-2-[5-(4-pyridylmethyl)-1H-pyrazol-4-yl]-3-sec-butoxy-propionic acid methyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(C1=CC=CO1)C(C2=C(NN=C2)CC3=CC=NC=C3)(C(=O)OC)OC

Isomeric SMILES

CCC(C)OC(C1=CC=CO1)C(C2=C(NN=C2)CC3=CC=NC=C3)(C(=O)OC)OC

InChI

InChI=1S/C22H27N3O5/c1-5-15(2)30-20(19-7-6-12-29-19)22(28-4,21(26)27-3)17-14-24-25-18(17)13-16-8-10-23-11-9-16/h6-12,14-15,20H,5,13H2,1-4H3,(H,24,25)