ethyl 3-[5-oxidanylidene-2-(phenylmethyl)-1H-pyrazol-4-yl]propanoate

Systemtic Name: ethyl 3-[5-oxidanylidene-2-(phenylmethyl)-1H-pyrazol-4-yl]propanoate Openeye Name: ethyl 3-(2-benzyl-5-oxo-1H-pyrazol-4-yl)propanoate CAS Name: 3-[5-oxo-2-(phenylmethyl)-1H-pyrazol-4-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(2-benzyl-5-oxo-1H-pyrazol-4-yl)propanoate Traditional Name: 3-(1-benzyl-3-keto-3-pyrazolin-4-yl)propionic acid ethyl ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CN(NC1=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CCC1=CN(NC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C15H18N2O3/c1-2-20-14(18)9-8-13-11-17(16-15(13)19)10-12-6-4-3-5-7-12/h3-7,11H,2,8-10H2,1H3,(H,16,19)