2-[(6S)-2-methyl-5-oxidanylidene-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]ethanoate

Systemtic Name: 2-[(6S)-2-methyl-5-oxidanylidene-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]ethanoate Openeye Name: 2-[(6S)-2-methyl-5-oxo-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetate CAS Name: 2-[(6S)-2-methyl-5-oxo-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetate IUPAC Name: 2-[(6S)-2-methyl-5-oxo-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetate Traditional Name: 2-[(6S)-5-keto-2-methyl-3-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetate Formula: C15H14N3O3- MolecularWeight: 284.28996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=O)C(CN2N1)CC(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=NC(=O)[C@H](CN2N1)CC(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C15H15N3O3/c1-9-13(10-5-3-2-4-6-10)14-16-15(21)11(7-12(19)20)8-18(14)17-9/h2-6,11,17H,7-8H2,1H3,(H,19,20)/p-1/t11-/m0/s1