(phenylmethyl) (3S,5S)-5-diethoxyphosphoryl-6-methyl-3-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylate

Systemtic Name: (phenylmethyl) (3S,5S)-5-diethoxyphosphoryl-6-methyl-3-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylate Openeye Name: benzyl (3S,5S)-5-diethoxyphosphoryl-6-methyl-3-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylate CAS Name: (3S,5S)-5-diethoxyphosphoryl-6-methyl-3-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3S,5S)-5-diethoxyphosphoryl-6-methyl-3-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylate Traditional Name: (3S,5S)-5-diethoxyphosphoryl-6-methyl-3-phenyl-4,5-dihydro-3H-pyridazine-2-carboxylic acid benzyl ester Formula: C23H29N2O5P MolecularWeight: 444.460521

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1CC(N(N=C1C)C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)OCC

Isomeric SMILES

CCOP(=O)([C@H]1C[C@H](N(N=C1C)C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)OCC

InChI

InChI=1S/C23H29N2O5P/c1-4-29-31(27,30-5-2)22-16-21(20-14-10-7-11-15-20)25(24-18(22)3)23(26)28-17-19-12-8-6-9-13-19/h6-15,21-22H,4-5,16-17H2,1-3H3/t21-,22-/m0/s1