[1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(1-phenylethylamino)ethyl] 1-butyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-butyl-6-oxo-3-pyridazinecarboxylic acid [1-oxo-1-(1-phenylethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1-phenylethylamino)propan-2-yl] 1-butyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-butyl-6-keto-pyridazine-3-carboxylic acid [2-keto-1-methyl-2-(1-phenylethylamino)ethyl] ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)OC(C)C(=O)NC(C)C2=CC=CC=C2

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)OC(C)C(=O)NC(C)C2=CC=CC=C2

InChI

InChI=1S/C20H25N3O4/c1-4-5-13-23-18(24)12-11-17(22-23)20(26)27-15(3)19(25)21-14(2)16-9-7-6-8-10-16/h6-12,14-15H,4-5,13H2,1-3H3,(H,21,25)