tert-butyl (5R)-6-oxidanylidene-5-(phenylmethyl)-4,5-dihydro-1H-pyridazine-3-carboxylate

Systemtic Name: tert-butyl (5R)-6-oxidanylidene-5-(phenylmethyl)-4,5-dihydro-1H-pyridazine-3-carboxylate Openeye Name: tert-butyl (5R)-5-benzyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate CAS Name: (5R)-6-oxo-5-(phenylmethyl)-4,5-dihydro-1H-pyridazine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (5R)-5-benzyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate Traditional Name: (5R)-5-benzyl-6-keto-4,5-dihydro-1H-pyridazine-3-carboxylic acid tert-butyl ester Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=NNC(=O)C(C1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C1=NNC(=O)[C@@H](C1)CC2=CC=CC=C2

InChI

InChI=1S/C16H20N2O3/c1-16(2,3)21-15(20)13-10-12(14(19)18-17-13)9-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,18,19)/t12-/m1/s1