1-(4-carboxy-2-propan-2-yl-phenyl)-5-[2-(cyclopropylmethoxy)-6-methoxy-phenyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-carboxy-2-propan-2-yl-phenyl)-5-[2-(cyclopropylmethoxy)-6-methoxy-phenyl]pyrazole-3-carboxylic acid Openeye Name: 1-(4-carboxy-2-isopropyl-phenyl)-5-[2-(cyclopropylmethoxy)-6-methoxy-phenyl]pyrazole-3-carboxylic acid CAS Name: 1-(4-carboxy-2-propan-2-ylphenyl)-5-[2-(cyclopropylmethoxy)-6-methoxyphenyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-(4-carboxy-2-propan-2-ylphenyl)-5-[2-(cyclopropylmethoxy)-6-methoxyphenyl]pyrazole-3-carboxylic acid Traditional Name: 1-(4-carboxy-2-isopropyl-phenyl)-5-[2-(cyclopropylmethoxy)-6-methoxy-phenyl]pyrazole-3-carboxylic acid Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)C(=O)O)N2C(=CC(=N2)C(=O)O)C3=C(C=CC=C3OCC4CC4)OC

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)C(=O)O)N2C(=CC(=N2)C(=O)O)C3=C(C=CC=C3OCC4CC4)OC

InChI

InChI=1S/C25H26N2O6/c1-14(2)17-11-16(24(28)29)9-10-19(17)27-20(12-18(26-27)25(30)31)23-21(32-3)5-4-6-22(23)33-13-15-7-8-15/h4-6,9-12,14-15H,7-8,13H2,1-3H3,(H,28,29)(H,30,31)