[2-(2,2-diphenylethylamino)-2-oxidanylidene-ethyl] 5,6-bis(chloranyl)pyridine-3-carboxylate

Systemtic Name: [2-(2,2-diphenylethylamino)-2-oxidanylidene-ethyl] 5,6-bis(chloranyl)pyridine-3-carboxylate Openeye Name: [2-(2,2-diphenylethylamino)-2-oxo-ethyl] 5,6-dichloropyridine-3-carboxylate CAS Name: 5,6-dichloro-3-pyridinecarboxylic acid [2-(2,2-diphenylethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,2-diphenylethylamino)-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate Traditional Name: 5,6-dichloronicotinic acid [2-(2,2-diphenylethylamino)-2-keto-ethyl] ester Formula: C22H18Cl2N2O3 MolecularWeight: 429.29592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CNC(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C22H18Cl2N2O3/c23-19-11-17(12-26-21(19)24)22(28)29-14-20(27)25-13-18(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-12,18H,13-14H2,(H,25,27)