methyl 4-[5-chloranyl-4-(3-methoxypropylamino)-6-oxidanylidene-pyridazin-1-yl]benzoate

Systemtic Name: methyl 4-[5-chloranyl-4-(3-methoxypropylamino)-6-oxidanylidene-pyridazin-1-yl]benzoate Openeye Name: methyl 4-[5-chloro-4-(3-methoxypropylamino)-6-oxo-pyridazin-1-yl]benzoate CAS Name: 4-[5-chloro-4-(3-methoxypropylamino)-6-oxo-1-pyridazinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-chloro-4-(3-methoxypropylamino)-6-oxopyridazin-1-yl]benzoate Traditional Name: 4-[5-chloro-6-keto-4-(3-methoxypropylamino)pyridazin-1-yl]benzoic acid methyl ester Formula: C16H18ClN3O4 MolecularWeight: 351.78482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=C(C(=O)N(N=C1)C2=CC=C(C=C2)C(=O)OC)Cl

Isomeric SMILES

COCCCNC1=C(C(=O)N(N=C1)C2=CC=C(C=C2)C(=O)OC)Cl

InChI

InChI=1S/C16H18ClN3O4/c1-23-9-3-8-18-13-10-19-20(15(21)14(13)17)12-6-4-11(5-7-12)16(22)24-2/h4-7,10,18H,3,8-9H2,1-2H3