3-(4-tert-butyl-2,5-diethoxy-phenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(4-tert-butyl-2,5-diethoxy-phenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(4-tert-butyl-2,5-diethoxy-phenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(4-tert-butyl-2,5-diethoxyphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(4-tert-butyl-2,5-diethoxyphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(4-tert-butyl-2,5-diethoxy-phenyl)-1H-pyrazole-5-carboxylic acid Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C2=NNC(=C2)C(=O)O)OCC)C(C)(C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1C2=NNC(=C2)C(=O)O)OCC)C(C)(C)C

InChI

InChI=1S/C18H24N2O4/c1-6-23-15-9-12(18(3,4)5)16(24-7-2)8-11(15)13-10-14(17(21)22)20-19-13/h8-10H,6-7H2,1-5H3,(H,19,20)(H,21,22)