ethyl (5S)-5-(4-methoxyphenyl)carbonyl-4-oxidanylidene-1,5-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl (5S)-5-(4-methoxyphenyl)carbonyl-4-oxidanylidene-1,5-dihydropyrazole-3-carboxylate Openeye Name: ethyl (5S)-5-(4-methoxybenzoyl)-4-oxo-1,5-dihydropyrazole-3-carboxylate CAS Name: (5S)-5-[(4-methoxyphenyl)-oxomethyl]-4-oxo-1,5-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5S)-5-(4-methoxybenzoyl)-4-oxo-1,5-dihydropyrazole-3-carboxylate Traditional Name: (5S)-4-keto-5-p-anisoyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=NN[C@H](C1=O)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C14H14N2O5/c1-3-21-14(19)11-13(18)10(15-16-11)12(17)8-4-6-9(20-2)7-5-8/h4-7,10,15H,3H2,1-2H3/t10-/m0/s1