1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[2-(3-oxidanylpropylamino)-5-(phenylcarbonyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[2-(3-oxidanylpropylamino)-5-(phenylcarbonyl)benzimidazol-1-yl]ethanone Openeye Name: 2-[5-benzoyl-2-(3-hydroxypropylamino)benzimidazol-1-yl]-1-(3,5-ditert-butyl-4-hydroxy-phenyl)ethanone CAS Name: 2-[5-benzoyl-2-(3-hydroxypropylamino)-1-benzimidazolyl]-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone IUPAC Name: 2-[5-benzoyl-2-(3-hydroxypropylamino)benzimidazol-1-yl]-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone Traditional Name: 2-[5-benzoyl-2-(3-hydroxypropylamino)benzimidazol-1-yl]-1-(3,5-ditert-butyl-4-hydroxy-phenyl)ethanone Formula: C33H39N3O4 MolecularWeight: 541.68046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)N=C2NCCCO

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)N=C2NCCCO

InChI

InChI=1S/C33H39N3O4/c1-32(2,3)24-17-23(18-25(30(24)40)33(4,5)6)28(38)20-36-27-14-13-22(29(39)21-11-8-7-9-12-21)19-26(27)35-31(36)34-15-10-16-37/h7-9,11-14,17-19,37,40H,10,15-16,20H2,1-6H3,(H,34,35)