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

Systemtic Name: tert-butyl (4R,5S)-4-methyl-6-oxidanylidene-5-(phenylmethyl)-4,5-dihydro-1H-pyridazine-3-carboxylate Openeye Name: tert-butyl (4R,5S)-5-benzyl-4-methyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate CAS Name: (4R,5S)-4-methyl-6-oxo-5-(phenylmethyl)-4,5-dihydro-1H-pyridazine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4R,5S)-5-benzyl-4-methyl-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate Traditional Name: (4R,5S)-5-benzyl-6-keto-4-methyl-4,5-dihydro-1H-pyridazine-3-carboxylic acid tert-butyl ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)NN=C1C(=O)OC(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

C[C@@H]1[C@@H](C(=O)NN=C1C(=O)OC(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O3/c1-11-13(10-12-8-6-5-7-9-12)15(20)19-18-14(11)16(21)22-17(2,3)4/h5-9,11,13H,10H2,1-4H3,(H,19,20)/t11-,13+/m1/s1