4-ethyl-2-(oxan-2-yloxy)-3-(1H-pyrazol-5-yl)benzoic acid

Systemtic Name: 4-ethyl-2-(oxan-2-yloxy)-3-(1H-pyrazol-5-yl)benzoic acid Openeye Name: 4-ethyl-3-(1H-pyrazol-5-yl)-2-tetrahydropyran-2-yloxy-benzoic acid CAS Name: 4-ethyl-2-(2-oxanyloxy)-3-(1H-pyrazol-5-yl)benzoic acid IUPAC Name: 4-ethyl-2-(oxan-2-yloxy)-3-(1H-pyrazol-5-yl)benzoic acid Traditional Name: 4-ethyl-3-(1H-pyrazol-5-yl)-2-tetrahydropyran-2-yloxy-benzoic acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)C(=O)O)OC2CCCCO2)C3=CC=NN3

Isomeric SMILES

CCC1=C(C(=C(C=C1)C(=O)O)OC2CCCCO2)C3=CC=NN3

InChI

InChI=1S/C17H20N2O4/c1-2-11-6-7-12(17(20)21)16(15(11)13-8-9-18-19-13)23-14-5-3-4-10-22-14/h6-9,14H,2-5,10H2,1H3,(H,18,19)(H,20,21)