piperidin-4-yl 4-azanyl-5-chloranyl-2-[3-(3-chloranyl-6-oxidanylidene-pyridazin-1-yl)propyl]-2,3-dihydro-1-benzofuran-7-carboxylate

Systemtic Name: piperidin-4-yl 4-azanyl-5-chloranyl-2-[3-(3-chloranyl-6-oxidanylidene-pyridazin-1-yl)propyl]-2,3-dihydro-1-benzofuran-7-carboxylate Openeye Name: 4-piperidyl 4-amino-5-chloro-2-[3-(3-chloro-6-oxo-pyridazin-1-yl)propyl]-2,3-dihydrobenzofuran-7-carboxylate CAS Name: 4-amino-5-chloro-2-[3-(3-chloro-6-oxo-1-pyridazinyl)propyl]-2,3-dihydrobenzofuran-7-carboxylic acid 4-piperidinyl ester IUPAC Name: piperidin-4-yl 4-amino-5-chloro-2-[3-(3-chloro-6-oxopyridazin-1-yl)propyl]-2,3-dihydro-1-benzofuran-7-carboxylate Traditional Name: 4-amino-5-chloro-2-[3-(3-chloro-6-keto-pyridazin-1-yl)propyl]coumaran-7-carboxylic acid 4-piperidyl ester Formula: C21H24Cl2N4O4 MolecularWeight: 467.34566

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1OC(=O)C2=CC(=C(C3=C2OC(C3)CCCN4C(=O)C=CC(=N4)Cl)N)Cl

Isomeric SMILES

C1CNCCC1OC(=O)C2=CC(=C(C3=C2OC(C3)CCCN4C(=O)C=CC(=N4)Cl)N)Cl

InChI

InChI=1S/C21H24Cl2N4O4/c22-16-11-15(21(29)31-12-5-7-25-8-6-12)20-14(19(16)24)10-13(30-20)2-1-9-27-18(28)4-3-17(23)26-27/h3-4,11-13,25H,1-2,5-10,24H2