dimethyl 5-(2-oxidanylpropyl)-2-phenyl-pyrazole-3,4-dicarboxylate

Systemtic Name: dimethyl 5-(2-oxidanylpropyl)-2-phenyl-pyrazole-3,4-dicarboxylate Openeye Name: dimethyl 5-(2-hydroxypropyl)-2-phenyl-pyrazole-3,4-dicarboxylate CAS Name: 5-(2-hydroxypropyl)-2-phenylpyrazole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(2-hydroxypropyl)-2-phenylpyrazole-3,4-dicarboxylate Traditional Name: 5-(2-hydroxypropyl)-2-phenyl-pyrazole-3,4-dicarboxylic acid dimethyl ester Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NN(C(=C1C(=O)OC)C(=O)OC)C2=CC=CC=C2)O

Isomeric SMILES

CC(CC1=NN(C(=C1C(=O)OC)C(=O)OC)C2=CC=CC=C2)O

InChI

InChI=1S/C16H18N2O5/c1-10(19)9-12-13(15(20)22-2)14(16(21)23-3)18(17-12)11-7-5-4-6-8-11/h4-8,10,19H,9H2,1-3H3