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

Systemtic Name: [2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 3,6-bis(chloranyl)pyridine-2-carboxylate Openeye Name: [2-(3,3-diphenylpropylamino)-2-oxo-ethyl] 3,6-dichloropyridine-2-carboxylate CAS Name: 3,6-dichloro-2-pyridinecarboxylic acid [2-(3,3-diphenylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,3-diphenylpropylamino)-2-oxoethyl] 3,6-dichloropyridine-2-carboxylate Traditional Name: 3,6-dichloropicolinic acid [2-(3,3-diphenylpropylamino)-2-keto-ethyl] ester Formula: C23H20Cl2N2O3 MolecularWeight: 443.3225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNC(=O)COC(=O)C2=C(C=CC(=N2)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CCNC(=O)COC(=O)C2=C(C=CC(=N2)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C23H20Cl2N2O3/c24-19-11-12-20(25)27-22(19)23(29)30-15-21(28)26-14-13-18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,18H,13-15H2,(H,26,28)