diethyl 2-[2-oxidanyl-2-[1-(phenylmethyl)benzimidazol-2-yl]ethyl]propanedioate

Systemtic Name: diethyl 2-[2-oxidanyl-2-[1-(phenylmethyl)benzimidazol-2-yl]ethyl]propanedioate Openeye Name: diethyl 2-[2-(1-benzylbenzimidazol-2-yl)-2-hydroxy-ethyl]propanedioate CAS Name: 2-[2-hydroxy-2-[1-(phenylmethyl)-2-benzimidazolyl]ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-(1-benzylbenzimidazol-2-yl)-2-hydroxyethyl]propanedioate Traditional Name: 2-[2-(1-benzylbenzimidazol-2-yl)-2-hydroxy-ethyl]malonic acid diethyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C1=NC2=CC=CC=C2N1CC3=CC=CC=C3)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC(C1=NC2=CC=CC=C2N1CC3=CC=CC=C3)O)C(=O)OCC

InChI

InChI=1S/C23H26N2O5/c1-3-29-22(27)17(23(28)30-4-2)14-20(26)21-24-18-12-8-9-13-19(18)25(21)15-16-10-6-5-7-11-16/h5-13,17,20,26H,3-4,14-15H2,1-2H3