tert-butyl 5-chloranyl-3-[2-methoxy-1-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-benzimidazole-1-carboxylate

Systemtic Name: tert-butyl 5-chloranyl-3-[2-methoxy-1-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-benzimidazole-1-carboxylate Openeye Name: tert-butyl 5-chloro-3-[2-methoxy-1-(3-methoxyphenyl)-2-oxo-ethyl]-2-oxo-benzimidazole-1-carboxylate CAS Name: 5-chloro-3-[2-methoxy-1-(3-methoxyphenyl)-2-oxoethyl]-2-oxo-1-benzimidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-chloro-3-[2-methoxy-1-(3-methoxyphenyl)-2-oxoethyl]-2-oxobenzimidazole-1-carboxylate Traditional Name: 5-chloro-2-keto-3-[2-keto-2-methoxy-1-(3-methoxyphenyl)ethyl]benzimidazole-1-carboxylic acid tert-butyl ester Formula: C22H23ClN2O6 MolecularWeight: 446.88082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)Cl)N(C1=O)C(C3=CC(=CC=C3)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)Cl)N(C1=O)C(C3=CC(=CC=C3)OC)C(=O)OC

InChI

InChI=1S/C22H23ClN2O6/c1-22(2,3)31-21(28)25-16-10-9-14(23)12-17(16)24(20(25)27)18(19(26)30-5)13-7-6-8-15(11-13)29-4/h6-12,18H,1-5H3