1-(4-methoxyphenyl)-4-methyl-5-(4-methylfuran-2-yl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-methoxyphenyl)-4-methyl-5-(4-methylfuran-2-yl)pyrazole-3-carboxylic acid Openeye Name: 1-(4-methoxyphenyl)-4-methyl-5-(4-methyl-2-furyl)pyrazole-3-carboxylic acid CAS Name: 1-(4-methoxyphenyl)-4-methyl-5-(4-methyl-2-furanyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(4-methoxyphenyl)-4-methyl-5-(4-methylfuran-2-yl)pyrazole-3-carboxylic acid Traditional Name: 1-(4-methoxyphenyl)-4-methyl-5-(4-methyl-2-furyl)pyrazole-3-carboxylic acid Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC(=C1)C2=C(C(=NN2C3=CC=C(C=C3)OC)C(=O)O)C

Isomeric SMILES

CC1=COC(=C1)C2=C(C(=NN2C3=CC=C(C=C3)OC)C(=O)O)C

InChI

InChI=1S/C17H16N2O4/c1-10-8-14(23-9-10)16-11(2)15(17(20)21)18-19(16)12-4-6-13(22-3)7-5-12/h4-9H,1-3H3,(H,20,21)