[(2S)-1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl] 3-oxidanylidene-2,4-dihydro-1H-pyridazine-6-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl] 3-oxidanylidene-2,4-dihydro-1H-pyridazine-6-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(4-phenoxyanilino)ethyl] 3-oxo-2,4-dihydro-1H-pyridazine-6-carboxylate CAS Name: 3-oxo-2,4-dihydro-1H-pyridazine-6-carboxylic acid [(2S)-1-oxo-1-(4-phenoxyanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(4-phenoxyanilino)propan-2-yl] 3-oxo-2,4-dihydro-1H-pyridazine-6-carboxylate Traditional Name: 3-keto-2,4-dihydro-1H-pyridazine-6-carboxylic acid [(1S)-2-keto-1-methyl-2-(4-phenoxyanilino)ethyl] ester Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)OC(=O)C3=CCC(=O)NN3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)OC(=O)C3=CCC(=O)NN3

InChI

InChI=1S/C20H19N3O5/c1-13(27-20(26)17-11-12-18(24)23-22-17)19(25)21-14-7-9-16(10-8-14)28-15-5-3-2-4-6-15/h2-11,13,22H,12H2,1H3,(H,21,25)(H,23,24)/t13-/m0/s1