methyl 2-[5-chloranyl-6-oxidanylidene-4-(2-oxidanylpropylamino)pyridazin-1-yl]benzoate

Systemtic Name: methyl 2-[5-chloranyl-6-oxidanylidene-4-(2-oxidanylpropylamino)pyridazin-1-yl]benzoate Openeye Name: methyl 2-[5-chloro-4-(2-hydroxypropylamino)-6-oxo-pyridazin-1-yl]benzoate CAS Name: 2-[5-chloro-4-(2-hydroxypropylamino)-6-oxo-1-pyridazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-chloro-4-(2-hydroxypropylamino)-6-oxopyridazin-1-yl]benzoate Traditional Name: 2-[5-chloro-4-(2-hydroxypropylamino)-6-keto-pyridazin-1-yl]benzoic acid methyl ester Formula: C15H16ClN3O4 MolecularWeight: 337.75824

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(C(=O)N(N=C1)C2=CC=CC=C2C(=O)OC)Cl)O

Isomeric SMILES

CC(CNC1=C(C(=O)N(N=C1)C2=CC=CC=C2C(=O)OC)Cl)O

InChI

InChI=1S/C15H16ClN3O4/c1-9(20)7-17-11-8-18-19(14(21)13(11)16)12-6-4-3-5-10(12)15(22)23-2/h3-6,8-9,17,20H,7H2,1-2H3