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

Systemtic Name: methyl 2-[5-chloranyl-4-(4-ethylpiperazin-1-yl)-6-oxidanylidene-pyridazin-1-yl]benzoate Openeye Name: methyl 2-[5-chloro-4-(4-ethylpiperazin-1-yl)-6-oxo-pyridazin-1-yl]benzoate CAS Name: 2-[5-chloro-4-(4-ethyl-1-piperazinyl)-6-oxo-1-pyridazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-chloro-4-(4-ethylpiperazin-1-yl)-6-oxopyridazin-1-yl]benzoate Traditional Name: 2-[5-chloro-4-(4-ethylpiperazino)-6-keto-pyridazin-1-yl]benzoic acid methyl ester Formula: C18H21ClN4O3 MolecularWeight: 376.83734

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3C(=O)OC)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=O)N(N=C2)C3=CC=CC=C3C(=O)OC)Cl

InChI

InChI=1S/C18H21ClN4O3/c1-3-21-8-10-22(11-9-21)15-12-20-23(17(24)16(15)19)14-7-5-4-6-13(14)18(25)26-2/h4-7,12H,3,8-11H2,1-2H3