diethyl 5-(3-methoxycarbonyl-4-oxidanyl-pyrazol-1-yl)benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-(3-methoxycarbonyl-4-oxidanyl-pyrazol-1-yl)benzene-1,3-dicarboxylate Openeye Name: diethyl 5-(4-hydroxy-3-methoxycarbonyl-pyrazol-1-yl)benzene-1,3-dicarboxylate CAS Name: 5-(4-hydroxy-3-methoxycarbonyl-1-pyrazolyl)benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(4-hydroxy-3-methoxycarbonylpyrazol-1-yl)benzene-1,3-dicarboxylate Traditional Name: 5-(3-carbomethoxy-4-hydroxy-pyrazol-1-yl)benzene-1,3-dicarboxylic acid diethyl ester Formula: C17H18N2O7 MolecularWeight: 362.33402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)N2C=C(C(=N2)C(=O)OC)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)N2C=C(C(=N2)C(=O)OC)O)C(=O)OCC

InChI

InChI=1S/C17H18N2O7/c1-4-25-15(21)10-6-11(16(22)26-5-2)8-12(7-10)19-9-13(20)14(18-19)17(23)24-3/h6-9,20H,4-5H2,1-3H3