tert-butyl 5,6-bis(chloranyl)-3-(2-ethoxy-2-oxidanylidene-1-phenyl-ethyl)-2-oxidanylidene-benzimidazole-1-carboxylate

Systemtic Name: tert-butyl 5,6-bis(chloranyl)-3-(2-ethoxy-2-oxidanylidene-1-phenyl-ethyl)-2-oxidanylidene-benzimidazole-1-carboxylate Openeye Name: tert-butyl 5,6-dichloro-3-(2-ethoxy-2-oxo-1-phenyl-ethyl)-2-oxo-benzimidazole-1-carboxylate CAS Name: 5,6-dichloro-3-(2-ethoxy-2-oxo-1-phenylethyl)-2-oxo-1-benzimidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5,6-dichloro-3-(2-ethoxy-2-oxo-1-phenylethyl)-2-oxobenzimidazole-1-carboxylate Traditional Name: 5,6-dichloro-3-(2-ethoxy-2-keto-1-phenyl-ethyl)-2-keto-benzimidazole-1-carboxylic acid tert-butyl ester Formula: C22H22Cl2N2O5 MolecularWeight: 465.32648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)N2C3=CC(=C(C=C3N(C2=O)C(=O)OC(C)(C)C)Cl)Cl

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)N2C3=CC(=C(C=C3N(C2=O)C(=O)OC(C)(C)C)Cl)Cl

InChI

InChI=1S/C22H22Cl2N2O5/c1-5-30-19(27)18(13-9-7-6-8-10-13)25-16-11-14(23)15(24)12-17(16)26(20(25)28)21(29)31-22(2,3)4/h6-12,18H,5H2,1-4H3