ethyl (3S,5S)-5-bromanyl-3-ethoxy-6-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylate

Systemtic Name: ethyl (3S,5S)-5-bromanyl-3-ethoxy-6-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylate Openeye Name: ethyl (3S,5S)-5-bromo-3-ethoxy-6-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylate CAS Name: (3S,5S)-5-bromo-3-ethoxy-6-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl (3S,5S)-5-bromo-3-ethoxy-6-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylate Traditional Name: (3S,5S)-5-bromo-3-ethoxy-6-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylic acid ethyl ester Formula: C15H19BrN2O3 MolecularWeight: 355.22696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC(C(=NN1C(=O)OCC)C2=CC=CC=C2)Br

Isomeric SMILES

CCO[C@H]1C[C@@H](C(=NN1C(=O)OCC)C2=CC=CC=C2)Br

InChI

InChI=1S/C15H19BrN2O3/c1-3-20-13-10-12(16)14(11-8-6-5-7-9-11)17-18(13)15(19)21-4-2/h5-9,12-13H,3-4,10H2,1-2H3/t12-,13-/m0/s1