1-[4-[(2S)-3-(2-butylbenzimidazol-1-yl)-2-oxidanyl-propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[(2S)-3-(2-butylbenzimidazol-1-yl)-2-oxidanyl-propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[(2S)-3-(2-butylbenzimidazol-1-yl)-2-hydroxy-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[(2S)-3-(2-butyl-1-benzimidazolyl)-2-hydroxypropoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[(2S)-3-(2-butylbenzimidazol-1-yl)-2-hydroxypropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[(2S)-3-(2-butylbenzimidazol-1-yl)-2-hydroxy-propoxy]phenyl]propan-1-one Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC(COC3=CC=C(C=C3)C(=O)CC)O

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1C[C@@H](COC3=CC=C(C=C3)C(=O)CC)O

InChI

InChI=1S/C23H28N2O3/c1-3-5-10-23-24-20-8-6-7-9-21(20)25(23)15-18(26)16-28-19-13-11-17(12-14-19)22(27)4-2/h6-9,11-14,18,26H,3-5,10,15-16H2,1-2H3/t18-/m0/s1