tert-butyl 3-oxidanyl-3-(2-phenethyl-1H-benzimidazol-4-yl)propanoate

Systemtic Name: tert-butyl 3-oxidanyl-3-(2-phenethyl-1H-benzimidazol-4-yl)propanoate Openeye Name: tert-butyl 3-hydroxy-3-(2-phenethyl-1H-benzimidazol-4-yl)propanoate CAS Name: 3-hydroxy-3-(2-phenethyl-1H-benzimidazol-4-yl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-hydroxy-3-(2-phenethyl-1H-benzimidazol-4-yl)propanoate Traditional Name: 3-hydroxy-3-(2-phenethyl-1H-benzimidazol-4-yl)propionic acid tert-butyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C1=C2C(=CC=C1)NC(=N2)CCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)CC(C1=C2C(=CC=C1)NC(=N2)CCC3=CC=CC=C3)O

InChI

InChI=1S/C22H26N2O3/c1-22(2,3)27-20(26)14-18(25)16-10-7-11-17-21(16)24-19(23-17)13-12-15-8-5-4-6-9-15/h4-11,18,25H,12-14H2,1-3H3,(H,23,24)