ethyl 4,6-bis(chloranyl)-3-(3-ethoxy-1-oxidanyl-3-oxidanylidene-2-pyridin-2-yl-propyl)-1H-indole-2-carboxylate

Systemtic Name: ethyl 4,6-bis(chloranyl)-3-(3-ethoxy-1-oxidanyl-3-oxidanylidene-2-pyridin-2-yl-propyl)-1H-indole-2-carboxylate Openeye Name: ethyl 4,6-dichloro-3-[3-ethoxy-1-hydroxy-3-oxo-2-(2-pyridyl)propyl]-1H-indole-2-carboxylate CAS Name: 4,6-dichloro-3-[3-ethoxy-1-hydroxy-3-oxo-2-(2-pyridinyl)propyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4,6-dichloro-3-(3-ethoxy-1-hydroxy-3-oxo-2-pyridin-2-ylpropyl)-1H-indole-2-carboxylate Traditional Name: 4,6-dichloro-3-[3-ethoxy-1-hydroxy-3-keto-2-(2-pyridyl)propyl]-1H-indole-2-carboxylic acid ethyl ester Formula: C21H20Cl2N2O5 MolecularWeight: 451.2999

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)C(C(C3=CC=CC=N3)C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)C(C(C3=CC=CC=N3)C(=O)OCC)O

InChI

InChI=1S/C21H20Cl2N2O5/c1-3-29-20(27)16(13-7-5-6-8-24-13)19(26)17-15-12(23)9-11(22)10-14(15)25-18(17)21(28)30-4-2/h5-10,16,19,25-26H,3-4H2,1-2H3