3-(4-ethoxycarbonyl-3-methyl-pyrazol-1-yl)-4-methyl-benzoic acid

Systemtic Name: 3-(4-ethoxycarbonyl-3-methyl-pyrazol-1-yl)-4-methyl-benzoic acid Openeye Name: 3-(4-ethoxycarbonyl-3-methyl-pyrazol-1-yl)-4-methyl-benzoic acid CAS Name: 3-(4-ethoxycarbonyl-3-methyl-1-pyrazolyl)-4-methylbenzoic acid IUPAC Name: 3-(4-ethoxycarbonyl-3-methylpyrazol-1-yl)-4-methylbenzoic acid Traditional Name: 3-(4-carbethoxy-3-methyl-pyrazol-1-yl)-4-methyl-benzoic acid Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=C1C)C2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=CN(N=C1C)C2=C(C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C15H16N2O4/c1-4-21-15(20)12-8-17(16-10(12)3)13-7-11(14(18)19)6-5-9(13)2/h5-8H,4H2,1-3H3,(H,18,19)