[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 1-(4-chlorophenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 1-(4-chlorophenyl)-6-methyl-4-oxo-pyridazine-3-carboxylate CAS Name: 1-(4-chlorophenyl)-6-methyl-4-oxo-3-pyridazinecarboxylic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 1-(4-chlorophenyl)-6-methyl-4-oxopyridazine-3-carboxylate Traditional Name: 1-(4-chlorophenyl)-4-keto-6-methyl-pyridazine-3-carboxylic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C18H20ClN3O4 MolecularWeight: 377.8221

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=NN(C(=CC1=O)C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=NN(C(=CC1=O)C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H20ClN3O4/c1-4-9-20-17(24)12(3)26-18(25)16-15(23)10-11(2)22(21-16)14-7-5-13(19)6-8-14/h5-8,10,12H,4,9H2,1-3H3,(H,20,24)/t12-/m0/s1