4-[3-(1-tert-butyl-5-propan-2-yl-pyrazol-3-yl)furan-2-yl]benzoic acid

Systemtic Name: 4-[3-(1-tert-butyl-5-propan-2-yl-pyrazol-3-yl)furan-2-yl]benzoic acid Openeye Name: 4-[3-(1-tert-butyl-5-isopropyl-pyrazol-3-yl)-2-furyl]benzoic acid CAS Name: 4-[3-(1-tert-butyl-5-propan-2-yl-3-pyrazolyl)-2-furanyl]benzoic acid IUPAC Name: 4-[3-(1-tert-butyl-5-propan-2-ylpyrazol-3-yl)furan-2-yl]benzoic acid Traditional Name: 4-[3-(1-tert-butyl-5-isopropyl-pyrazol-3-yl)-2-furyl]benzoic acid Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NN1C(C)(C)C)C2=C(OC=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC(=NN1C(C)(C)C)C2=C(OC=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H24N2O3/c1-13(2)18-12-17(22-23(18)21(3,4)5)16-10-11-26-19(16)14-6-8-15(9-7-14)20(24)25/h6-13H,1-5H3,(H,24,25)