ethyl 1-(3-methoxyphenyl)carbonyl-5-methyl-5-oxidanyl-4H-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(3-methoxyphenyl)carbonyl-5-methyl-5-oxidanyl-4H-pyrazole-3-carboxylate Openeye Name: ethyl 5-hydroxy-1-(3-methoxybenzoyl)-5-methyl-4H-pyrazole-3-carboxylate CAS Name: 5-hydroxy-1-[(3-methoxyphenyl)-oxomethyl]-5-methyl-4H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-1-(3-methoxybenzoyl)-5-methyl-4H-pyrazole-3-carboxylate Traditional Name: 5-hydroxy-1-m-anisoyl-5-methyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(C1)(C)O)C(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

CCOC(=O)C1=NN(C(C1)(C)O)C(=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C15H18N2O5/c1-4-22-14(19)12-9-15(2,20)17(16-12)13(18)10-6-5-7-11(8-10)21-3/h5-8,20H,4,9H2,1-3H3