[2-(dibenzofuran-2-ylamino)-2-oxidanylidene-ethyl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: [2-(dibenzofuran-2-ylamino)-2-oxidanylidene-ethyl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: [2-(dibenzofuran-2-ylamino)-2-oxo-ethyl] 2-chloro-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-3-pyridinecarboxylic acid [2-(2-dibenzofuranylamino)-2-oxoethyl] ester IUPAC Name: [2-(dibenzofuran-2-ylamino)-2-oxoethyl] 2-chloro-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-nicotinic acid [2-(dibenzofuran-2-ylamino)-2-keto-ethyl] ester Formula: C22H17ClN2O4 MolecularWeight: 408.83438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)OCC(=O)NC2=CC3=C(C=C2)OC4=CC=CC=C43)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)OCC(=O)NC2=CC3=C(C=C2)OC4=CC=CC=C43)Cl)C

InChI

InChI=1S/C22H17ClN2O4/c1-12-9-13(2)24-21(23)20(12)22(27)28-11-19(26)25-14-7-8-18-16(10-14)15-5-3-4-6-17(15)29-18/h3-10H,11H2,1-2H3,(H,25,26)