[2-[(6-chloranyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate

Systemtic Name: [2-[(6-chloranyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate Openeye Name: [2-[(6-chloro-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl] 6-oxo-1-propyl-pyridazine-3-carboxylate CAS Name: 6-oxo-1-propyl-3-pyridazinecarboxylic acid [2-[(6-chloro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-chloro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 6-oxo-1-propylpyridazine-3-carboxylate Traditional Name: 6-keto-1-propyl-pyridazine-3-carboxylic acid [2-[(6-chloro-1,3-benzodioxol-5-yl)amino]-2-keto-ethyl] ester Formula: C17H16ClN3O6 MolecularWeight: 393.77844

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)OCC(=O)NC2=CC3=C(C=C2Cl)OCO3

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)OCC(=O)NC2=CC3=C(C=C2Cl)OCO3

InChI

InChI=1S/C17H16ClN3O6/c1-2-5-21-16(23)4-3-11(20-21)17(24)25-8-15(22)19-12-7-14-13(6-10(12)18)26-9-27-14/h3-4,6-7H,2,5,8-9H2,1H3,(H,19,22)