3-(3,5-ditert-butyl-2-methoxy-phenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(3,5-ditert-butyl-2-methoxy-phenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(3,5-ditert-butyl-2-methoxy-phenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(3,5-ditert-butyl-2-methoxyphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(3,5-ditert-butyl-2-methoxyphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(3,5-ditert-butyl-2-methoxy-phenyl)-1H-pyrazole-5-carboxylic acid Formula: C19H26N2O3 MolecularWeight: 330.42134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C2=NNC(=C2)C(=O)O)OC)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C2=NNC(=C2)C(=O)O)OC)C(C)(C)C

InChI

InChI=1S/C19H26N2O3/c1-18(2,3)11-8-12(14-10-15(17(22)23)21-20-14)16(24-7)13(9-11)19(4,5)6/h8-10H,1-7H3,(H,20,21)(H,22,23)