[2-(2,2-diphenylethylamino)-2-oxidanylidene-ethyl] 6-chloranylpyridine-3-carboxylate

Systemtic Name: [2-(2,2-diphenylethylamino)-2-oxidanylidene-ethyl] 6-chloranylpyridine-3-carboxylate Openeye Name: [2-(2,2-diphenylethylamino)-2-oxo-ethyl] 6-chloropyridine-3-carboxylate CAS Name: 6-chloro-3-pyridinecarboxylic acid [2-(2,2-diphenylethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,2-diphenylethylamino)-2-oxoethyl] 6-chloropyridine-3-carboxylate Traditional Name: 6-chloronicotinic acid [2-(2,2-diphenylethylamino)-2-keto-ethyl] ester Formula: C22H19ClN2O3 MolecularWeight: 394.85086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN2O3/c23-20-12-11-18(13-24-20)22(27)28-15-21(26)25-14-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-13,19H,14-15H2,(H,25,26)