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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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