4-[2-(5-ethoxycarbonyl-1H-pyrazol-3-yl)-5-(pyridin-3-ylmethoxy)phenoxy]-4-(2-ethylphenyl)butanoate

Systemtic Name: 4-[2-(5-ethoxycarbonyl-1H-pyrazol-3-yl)-5-(pyridin-3-ylmethoxy)phenoxy]-4-(2-ethylphenyl)butanoate Openeye Name: 4-[2-(5-ethoxycarbonyl-1H-pyrazol-3-yl)-5-(3-pyridylmethoxy)phenoxy]-4-(2-ethylphenyl)butanoate CAS Name: 4-[2-(5-ethoxycarbonyl-1H-pyrazol-3-yl)-5-(3-pyridinylmethoxy)phenoxy]-4-(2-ethylphenyl)butanoate IUPAC Name: 4-[2-(5-ethoxycarbonyl-1H-pyrazol-3-yl)-5-(pyridin-3-ylmethoxy)phenoxy]-4-(2-ethylphenyl)butanoate Traditional Name: 4-[2-(5-carbethoxy-1H-pyrazol-3-yl)-5-(3-pyridylmethoxy)phenoxy]-4-(2-ethylphenyl)butyrate Formula: C30H30N3O6- MolecularWeight: 528.5757

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C(CCC(=O)[O-])OC2=C(C=CC(=C2)OCC3=CN=CC=C3)C4=NNC(=C4)C(=O)OCC

Isomeric SMILES

CCC1=CC=CC=C1C(CCC(=O)[O-])OC2=C(C=CC(=C2)OCC3=CN=CC=C3)C4=NNC(=C4)C(=O)OCC

InChI

InChI=1S/C30H31N3O6/c1-3-21-9-5-6-10-23(21)27(13-14-29(34)35)39-28-16-22(38-19-20-8-7-15-31-18-20)11-12-24(28)25-17-26(33-32-25)30(36)37-4-2/h5-12,15-18,27H,3-4,13-14,19H2,1-2H3,(H,32,33)(H,34,35)/p-1