butyl (4S)-5-ethanoyl-2-phenyl-3,4-dihydropyrazole-4-carboxylate

Systemtic Name: butyl (4S)-5-ethanoyl-2-phenyl-3,4-dihydropyrazole-4-carboxylate Openeye Name: butyl (4S)-5-acetyl-2-phenyl-3,4-dihydropyrazole-4-carboxylate CAS Name: (4S)-5-acetyl-2-phenyl-3,4-dihydropyrazole-4-carboxylic acid butyl ester IUPAC Name: butyl (4S)-5-acetyl-2-phenyl-3,4-dihydropyrazole-4-carboxylate Traditional Name: (4S)-3-acetyl-1-phenyl-2-pyrazoline-4-carboxylic acid butyl ester Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CN(N=C1C(=O)C)C2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)[C@H]1CN(N=C1C(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C16H20N2O3/c1-3-4-10-21-16(20)14-11-18(17-15(14)12(2)19)13-8-6-5-7-9-13/h5-9,14H,3-4,10-11H2,1-2H3/t14-/m0/s1