[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: [1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 1-butyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-butyl-6-oxo-3-pyridazinecarboxylic acid [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 1-butyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-butyl-6-keto-pyridazine-3-carboxylic acid [2-keto-1-methyl-2-(p-anisylamino)ethyl] ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H25N3O5/c1-4-5-12-23-18(24)11-10-17(22-23)20(26)28-14(2)19(25)21-13-15-6-8-16(27-3)9-7-15/h6-11,14H,4-5,12-13H2,1-3H3,(H,21,25)