[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxylate

Systemtic Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxylate Openeye Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxylate CAS Name: 6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxylic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxylate Traditional Name: 6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxylic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C22H17BrN4O5 MolecularWeight: 497.29818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)OCC3=NC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)OCC3=NC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H17BrN4O5/c23-16-6-4-5-15(13-16)21-24-19(32-26-21)14-31-22(29)18-9-10-20(28)27(25-18)11-12-30-17-7-2-1-3-8-17/h1-10,13H,11-12,14H2