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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O3/c1-15(2)14-27-21(26)13-19(25)17-9-6-10-18-22(17)24-20(23-18)12-11-16-7-4-3-5-8-16/h3-10,15,19,25H,11-14H2,1-2H3,(H,23,24)