methyl 2-[4-[1-(3-bromophenyl)ethylamino]-5-chloranyl-6-oxidanylidene-pyridazin-1-yl]benzoate

Systemtic Name: methyl 2-[4-[1-(3-bromophenyl)ethylamino]-5-chloranyl-6-oxidanylidene-pyridazin-1-yl]benzoate Openeye Name: methyl 2-[4-[1-(3-bromophenyl)ethylamino]-5-chloro-6-oxo-pyridazin-1-yl]benzoate CAS Name: 2-[4-[1-(3-bromophenyl)ethylamino]-5-chloro-6-oxo-1-pyridazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[1-(3-bromophenyl)ethylamino]-5-chloro-6-oxopyridazin-1-yl]benzoate Traditional Name: 2-[4-[1-(3-bromophenyl)ethylamino]-5-chloro-6-keto-pyridazin-1-yl]benzoic acid methyl ester Formula: C20H17BrClN3O3 MolecularWeight: 462.72428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC2=C(C(=O)N(N=C2)C3=CC=CC=C3C(=O)OC)Cl

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC2=C(C(=O)N(N=C2)C3=CC=CC=C3C(=O)OC)Cl

InChI

InChI=1S/C20H17BrClN3O3/c1-12(13-6-5-7-14(21)10-13)24-16-11-23-25(19(26)18(16)22)17-9-4-3-8-15(17)20(27)28-2/h3-12,24H,1-2H3